3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide

C190H177N39O16 — CID 159057067

IUPAC3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide
SMILESCN(C)CCCNC(=O)c1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)ccc3C1)CO2.CON(C)C(=O)c1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)ccc3C1)CO2.COc1ccc(CCNC(=O)c2ccc3c(c2)CC(C2=Nc4cc(-c5ccnc(N)n5)ccc4C2)CO3)cc1.NC(=O)c1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)ccc3C1)CO2.Nc1nccc(-c2ccc3c(c2)N=C(C2COc4ccc(C(=O)NCCc5ccccn5)cc4C2)C3)n1.Nc1nccc(-c2ccc3c(c2)N=C(C2COc4ccc(C(=O)NCCc5cccnc5)cc4C2)C3)n1.Nc1nccc(-c2ccc3c(c2)N=C(C2COc4ccc(C(=O)NCc5cccnc5)cc4C2)C3)n1
InChIInChI=1S/C31H29N5O3.2C29H26N6O2.C28H24N6O2.C27H30N6O2.C24H23N5O3.C22H19N5O2/c1-38-25-7-2-19(3-8-25)10-12-33-30(37)22-6-9-29-23(14-22)15-24(18-39-29)28-17-21-5-4-20(16-27(21)35-28)26-11-13-34-31(32)36-26;30-29-33-11-8-24(35-29)19-3-4-20-15-26(34-25(20)14-19)23-13-22-12-21(5-6-27(22)37-17-23)28(36)32-10-7-18-2-1-9-31-16-18;30-29-33-12-9-24(35-29)18-4-5-19-16-26(34-25(19)15-18)22-14-21-13-20(6-7-27(21)37-17-22)28(36)32-11-8-23-3-1-2-10-31-23;29-28-31-9-7-23(34-28)18-3-4-19-13-25(33-24(19)12-18)22-11-21-10-20(5-6-26(21)36-16-22)27(35)32-15-17-2-1-8-30-14-17;1-33(2)11-3-9-29-26(34)19-6-7-25-20(12-19)13-21(16-35-25)24-15-18-5-4-17(14-23(18)31-24)22-8-10-30-27(28)32-22;1-29(31-2)23(30)16-5-6-22-17(9-16)10-18(13-32-22)21-12-15-4-3-14(11-20(15)27-21)19-7-8-26-24(25)28-19;23-21(28)14-3-4-20-15(7-14)8-16(11-29-20)19-10-13-2-1-12(9-18(13)26-19)17-5-6-25-22(24)27-17/h2-9,11,13-14,16,24H,10,12,15,17-18H2,1H3,(H,33,37)(H2,32,34,36);1-6,8-9,11-12,14,16,23H,7,10,13,15,17H2,(H,32,36)(H2,30,33,35);1-7,9-10,12-13,15,22H,8,11,14,16-17H2,(H,32,36)(H2,30,33,35);1-10,12,14,22H,11,13,15-16H2,(H,32,35)(H2,29,31,34);4-8,10,12,14,21H,3,9,11,13,15-16H2,1-2H3,(H,29,34)(H2,28,30,32);3-9,11,18H,10,12-13H2,1-2H3,(H2,25,26,28);1-7,9,16H,8,10-11H2,(H2,23,28)(H2,24,25,27)
InChIKeyJXZKCEPXKQUFTQ-UHFFFAOYSA-N
MW3262.76 g/mol
LogP25.69
Rot. Bonds38

About 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide

3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide (PubChem CID 159057067) has the molecular formula C190H177N39O16 and a molecular weight of 3262.76 g/mol. Its IUPAC name is 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide.

Molecular Properties

Compound Name3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide
PubChem CID159057067
Molecular FormulaC190H177N39O16
Molecular Weight3262.76 g/mol
Exact Mass3260.42
IUPAC Name3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide
SMILESCN(C)CCCNC(=O)c1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)ccc3C1)CO2.CON(C)C(=O)c1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)ccc3C1)CO2.COc1ccc(CCNC(=O)c2ccc3c(c2)CC(C2=Nc4cc(-c5ccnc(N)n5)ccc4C2)CO3)cc1.NC(=O)c1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)ccc3C1)CO2.Nc1nccc(-c2ccc3c(c2)N=C(C2COc4ccc(C(=O)NCCc5ccccn5)cc4C2)C3)n1.Nc1nccc(-c2ccc3c(c2)N=C(C2COc4ccc(C(=O)NCCc5cccnc5)cc4C2)C3)n1.Nc1nccc(-c2ccc3c(c2)N=C(C2COc4ccc(C(=O)NCc5cccnc5)cc4C2)C3)n1
InChIInChI=1S/C31H29N5O3.2C29H26N6O2.C28H24N6O2.C27H30N6O2.C24H23N5O3.C22H19N5O2/c1-38-25-7-2-19(3-8-25)10-12-33-30(37)22-6-9-29-23(14-22)15-24(18-39-29)28-17-21-5-4-20(16-27(21)35-28)26-11-13-34-31(32)36-26;30-29-33-11-8-24(35-29)19-3-4-20-15-26(34-25(20)14-19)23-13-22-12-21(5-6-27(22)37-17-23)28(36)32-10-7-18-2-1-9-31-16-18;30-29-33-12-9-24(35-29)18-4-5-19-16-26(34-25(19)15-18)22-14-21-13-20(6-7-27(21)37-17-22)28(36)32-11-8-23-3-1-2-10-31-23;29-28-31-9-7-23(34-28)18-3-4-19-13-25(33-24(19)12-18)22-11-21-10-20(5-6-26(21)36-16-22)27(35)32-15-17-2-1-8-30-14-17;1-33(2)11-3-9-29-26(34)19-6-7-25-20(12-19)13-21(16-35-25)24-15-18-5-4-17(14-23(18)31-24)22-8-10-30-27(28)32-22;1-29(31-2)23(30)16-5-6-22-17(9-16)10-18(13-32-22)21-12-15-4-3-14(11-20(15)27-21)19-7-8-26-24(25)28-19;23-21(28)14-3-4-20-15(7-14)8-16(11-29-20)19-10-13-2-1-12(9-18(13)26-19)17-5-6-25-22(24)27-17/h2-9,11,13-14,16,24H,10,12,15,17-18H2,1H3,(H,33,37)(H2,32,34,36);1-6,8-9,11-12,14,16,23H,7,10,13,15,17H2,(H,32,36)(H2,30,33,35);1-7,9-10,12-13,15,22H,8,11,14,16-17H2,(H,32,36)(H2,30,33,35);1-10,12,14,22H,11,13,15-16H2,(H,32,35)(H2,29,31,34);4-8,10,12,14,21H,3,9,11,13,15-16H2,1-2H3,(H,29,34)(H2,28,30,32);3-9,11,18H,10,12-13H2,1-2H3,(H2,25,26,28);1-7,9,16H,8,10-11H2,(H2,23,28)(H2,24,25,27)
InChIKeyJXZKCEPXKQUFTQ-UHFFFAOYSA-N
XLogP25.69
TPSA783.00 Ų
H-Bond Donors13
H-Bond Acceptors48
Rotatable Bonds38
Heavy Atoms245
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003262.76
LogP ≤ 525.69
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1048

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide with MolForge

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Related Compounds

3-[6-(2-aminopyrimidin-4-yl)-4-fluoro-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide
CID 58164036
3-[6-(2-aminopyrimidin-4-yl)-4-fluoro-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide
CID 58164110
3-[6-(2-aminopyrimidin-4-yl)-4-fluoro-3H-indol-2-yl]-N-[2-(dimethylamino)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide
CID 58164155
3-[6-(2-aminopyrimidin-4-yl)-4-fluoro-3H-indol-2-yl]-N-cyclopentyl-3,4-dihydro-2H-chromene-6-carboxamide
CID 58164192
3-[6-(2-aminopyrimidin-4-yl)-4-fluoro-3H-indol-2-yl]-N-cyclobutyl-3,4-dihydro-2H-chromene-6-carboxamide
CID 58164318
3-[6-(2-aminopyrimidin-4-yl)-4-fluoro-3H-indol-2-yl]-N-(2-methylpropyl)-3,4-dihydro-2H-chromene-6-carboxamide
CID 58164332
3-[6-(2-aminopyrimidin-4-yl)-4-fluoro-3H-indol-2-yl]-N-cyclopropyl-3,4-dihydro-2H-chromene-6-carboxamide
CID 58164396
3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[(2,4-difluorophenyl)methyl]benzamide;3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-ethyl-N-methylbenzamide;3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide;3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide;N-[4-[2-[3-(4-acetylpiperazine-1-carbonyl)anilino]pyrimidin-4-yl]phenyl]acetamide
CID 157241863
N-[3-[[4-(4-methoxyphenyl)pyrimidin-2-yl]amino]phenyl]-4-(piperidin-1-ylmethyl)benzamide;N-[3-[[4-(4-methylphenyl)pyrimidin-2-yl]amino]phenyl]-4-(piperidin-1-ylmethyl)benzamide;4-methyl-3-[(4-phenylpyrimidin-2-yl)amino]-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]benzamide;4-methyl-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]-3-[[4-[3-(trifluoromethyl)phenyl]pyrimidin-2-yl]amino]benzamide;N-[3-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]amino]phenyl]-4-(piperidin-1-ylmethyl)benzamide
CID 157977805
3-[4-(cyclopropylmethoxy)phenyl]-2-propan-2-ylpyridine;3-[4-(1,1-difluoroethoxy)phenyl]-2-propan-2-ylpyridine;2-fluoro-5-(1-hydroxy-2-propan-2-ylpyridin-1-ium-3-yl)-N-methylbenzamide;2-fluoro-N-methyl-5-(4-propan-2-ylpyrimidin-5-yl)benzamide;3-[4-(2-methoxyethoxy)phenyl]-2-propan-2-ylpyridine;3-[4-(methoxymethyl)phenyl]-2-propan-2-ylpyridine;5-naphthalen-1-yl-4-propan-2-ylpyrimidine;5-naphthalen-2-yl-4-propan-2-ylpyrimidine;bis(3-(4-propan-2-ylpyrimidin-5-yl)-7H-cyclopenta[b]pyridine)
CID 160069564
3-[4-(cyclopropylmethoxy)phenyl]-2-propan-2-ylpyridine;3-[4-(1,1-difluoroethoxy)phenyl]-2-propan-2-ylpyridine;2-fluoro-5-(1-hydroxy-2-propan-2-ylpyridin-1-ium-3-yl)-N-methylbenzamide;3-[4-(2-methoxyethoxy)phenyl]-2-propan-2-ylpyridine;3-[4-(methoxymethyl)phenyl]-2-propan-2-ylpyridine;5-naphthalen-1-yl-4-propan-2-ylpyrimidine
CID 160389274
[4-(methylamino)-2-quinolin-3-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]-[4-[[2-methyl-4-[3-(4-methylpiperazin-1-yl)prop-1-ynyl]phenoxy]methyl]phenyl]methanone
CID 177895757

Frequently Asked Questions

What is the IUPAC name of 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide?
The IUPAC name of 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide (CID 159057067) is 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide.
What is the SMILES notation for 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide?
The canonical SMILES for 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide is CN(C)CCCNC(=O)c1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)ccc3C1)CO2.CON(C)C(=O)c1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)ccc3C1)CO2.COc1ccc(CCNC(=O)c2ccc3c(c2)CC(C2=Nc4cc(-c5ccnc(N)n5)ccc4C2)CO3)cc1.NC(=O)c1ccc2c(c1)CC(C1=Nc3cc(-c4ccnc(N)n4)ccc3C1)CO2.Nc1nccc(-c2ccc3c(c2)N=C(C2COc4ccc(C(=O)NCCc5ccccn5)cc4C2)C3)n1.Nc1nccc(-c2ccc3c(c2)N=C(C2COc4ccc(C(=O)NCCc5cccnc5)cc4C2)C3)n1.Nc1nccc(-c2ccc3c(c2)N=C(C2COc4ccc(C(=O)NCc5cccnc5)cc4C2)C3)n1.
What is the InChIKey of 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide?
The InChIKey is JXZKCEPXKQUFTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H29N5O3.2C29H26N6O2.C28H24N6O2.C27H30N6O2.C24H23N5O3.C22H19N5O2/c1-38-25-7-2-19(3-8-25)10-12-33-30(37)22-6-9-29-23(14-22)15-24(18-39-29)28-17-21-5-4-20(16-27(21)35-28)26-11-13-34-31(32)36-26;30-29-33-11-8-24(35-29)19-3-4-20-15-26(34-25(20)14-19)23-13-22-12-21(5-6-27(22)37-17-23)28(36)32-10-7-18-2-1-9-31-16-18;30-29-33-12-9-24(35-29)18-4-5-19-16-26(34-25(19)15-18)22-14-21-13-20(6-7-27(21)37-17-22)28(36)32-11-8-23-3-1-2-10-31-23;29-28-31-9-7-23(34-28)18-3-4-19-13-25(33-24(19)12-18)22-11-21-10-20(5-6-26(21)36-16-22)27(35)32-15-17-2-1-8-30-14-17;1-33(2)11-3-9-29-26(34)19-6-7-25-20(12-19)13-21(16-35-25)24-15-18-5-4-17(14-23(18)31-24)22-8-10-30-27(28)32-22;1-29(31-2)23(30)16-5-6-22-17(9-16)10-18(13-32-22)21-12-15-4-3-14(11-20(15)27-21)19-7-8-26-24(25)28-19;23-21(28)14-3-4-20-15(7-14)8-16(11-29-20)19-10-13-2-1-12(9-18(13)26-19)17-5-6-25-22(24)27-17/h2-9,11,13-14,16,24H,10,12,15,17-18H2,1H3,(H,33,37)(H2,32,34,36);1-6,8-9,11-12,14,16,23H,7,10,13,15,17H2,(H,32,36)(H2,30,33,35);1-7,9-10,12-13,15,22H,8,11,14,16-17H2,(H,32,36)(H2,30,33,35);1-10,12,14,22H,11,13,15-16H2,(H,32,35)(H2,29,31,34);4-8,10,12,14,21H,3,9,11,13,15-16H2,1-2H3,(H,29,34)(H2,28,30,32);3-9,11,18H,10,12-13H2,1-2H3,(H2,25,26,28);1-7,9,16H,8,10-11H2,(H2,23,28)(H2,24,25,27).
What are the key properties of 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide?
3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide has a molecular weight of 3262.76 g/mol, XLogP of 25.69, 38 rotatable bonds, 13 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[3-(dimethylamino)propyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-methoxy-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(2-pyridin-3-ylethyl)-3,4-dihydro-2H-chromene-6-carboxamide;3-[6-(2-aminopyrimidin-4-yl)-3H-indol-2-yl]-N-(pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-6-carboxamide is sourced from PubChem (CID 159057067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).