N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride

C119H138ClN31O4 — CID 167621548

IUPACN-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride
SMILESCC(C)n1ccc2ccc3cnc(Nc4ccc(N5CCC6(CCNCC6)C5)cn4)nc3c21.CC(C)n1ccc2ccc3cnc(Nc4ccc(N5C[C@@H](C)O[C@@H](C)C5)cn4)nc3c21.CC1CN(c2ccc(Nc3ncc4ccc5ccn(C(C)C)c5c4n3)nc2)CCO1.Cc1cc(Nc2ncc3ccc4ccn(C(C)C)c4c3n2)ncc1N1CCOCC1.Cc1nc(Nc2ncc3ccc4ccn(C(C)C)c4c3n2)ccc1N1CCOCC1.Cl
InChIInChI=1S/C26H31N7.C24H28N6O.3C23H26N6O.ClH/c1-18(2)33-13-7-19-3-4-20-15-29-25(31-23(20)24(19)33)30-22-6-5-21(16-28-22)32-14-10-26(17-32)8-11-27-12-9-26;1-15(2)30-10-9-18-5-6-19-11-26-24(28-22(19)23(18)30)27-21-8-7-20(12-25-21)29-13-16(3)31-17(4)14-29;1-15(2)29-7-6-17-4-5-18-13-25-23(27-21(18)22(17)29)26-20-12-16(3)19(14-24-20)28-8-10-30-11-9-28;1-15(2)29-9-8-17-4-5-18-14-24-23(27-21(18)22(17)29)26-20-7-6-19(16(3)25-20)28-10-12-30-13-11-28;1-15(2)29-9-8-17-4-5-18-12-25-23(27-21(18)22(17)29)26-20-7-6-19(13-24-20)28-10-11-30-16(3)14-28;/h3-7,13,15-16,18,27H,8-12,14,17H2,1-2H3,(H,28,29,30,31);5-12,15-17H,13-14H2,1-4H3,(H,25,26,27,28);4-7,12-15H,8-11H2,1-3H3,(H,24,25,26,27);4-9,14-15H,10-13H2,1-3H3,(H,24,25,26,27);4-9,12-13,15-16H,10-11,14H2,1-3H3,(H,24,25,26,27);1H/t;16-,17+;;;;
InChIKeyYDJVMNWXSRPDJI-IXSFNYSNSA-N
MW2102.08 g/mol
LogP23.65
Rot. Bonds20

About N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride

N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride (PubChem CID 167621548) has the molecular formula C119H138ClN31O4 and a molecular weight of 2102.08 g/mol. Its IUPAC name is N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride.

Molecular Properties

Compound NameN-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride
PubChem CID167621548
Molecular FormulaC119H138ClN31O4
Molecular Weight2102.08 g/mol
Exact Mass2100.12
IUPAC NameN-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride
SMILESCC(C)n1ccc2ccc3cnc(Nc4ccc(N5CCC6(CCNCC6)C5)cn4)nc3c21.CC(C)n1ccc2ccc3cnc(Nc4ccc(N5C[C@@H](C)O[C@@H](C)C5)cn4)nc3c21.CC1CN(c2ccc(Nc3ncc4ccc5ccn(C(C)C)c5c4n3)nc2)CCO1.Cc1cc(Nc2ncc3ccc4ccn(C(C)C)c4c3n2)ncc1N1CCOCC1.Cc1nc(Nc2ncc3ccc4ccn(C(C)C)c4c3n2)ccc1N1CCOCC1.Cl
InChIInChI=1S/C26H31N7.C24H28N6O.3C23H26N6O.ClH/c1-18(2)33-13-7-19-3-4-20-15-29-25(31-23(20)24(19)33)30-22-6-5-21(16-28-22)32-14-10-26(17-32)8-11-27-12-9-26;1-15(2)30-10-9-18-5-6-19-11-26-24(28-22(19)23(18)30)27-21-8-7-20(12-25-21)29-13-16(3)31-17(4)14-29;1-15(2)29-7-6-17-4-5-18-13-25-23(27-21(18)22(17)29)26-20-12-16(3)19(14-24-20)28-8-10-30-11-9-28;1-15(2)29-9-8-17-4-5-18-14-24-23(27-21(18)22(17)29)26-20-7-6-19(16(3)25-20)28-10-12-30-13-11-28;1-15(2)29-9-8-17-4-5-18-12-25-23(27-21(18)22(17)29)26-20-7-6-19(13-24-20)28-10-11-30-16(3)14-28;/h3-7,13,15-16,18,27H,8-12,14,17H2,1-2H3,(H,28,29,30,31);5-12,15-17H,13-14H2,1-4H3,(H,25,26,27,28);4-7,12-15H,8-11H2,1-3H3,(H,24,25,26,27);4-9,14-15H,10-13H2,1-3H3,(H,24,25,26,27);4-9,12-13,15-16H,10-11,14H2,1-3H3,(H,24,25,26,27);1H/t;16-,17+;;;;
InChIKeyYDJVMNWXSRPDJI-IXSFNYSNSA-N
XLogP23.65
TPSA343.30 Ų
H-Bond Donors6
H-Bond Acceptors35
Rotatable Bonds20
Heavy Atoms155
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002102.08
LogP ≤ 523.65
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1035

Analyze N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride with MolForge

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Related Compounds

(R)-N-(1-Morpholinopropan-2-yl)-6-(8-(pyridin-4-yl)-1H-imidazo[4,5-c][1,7]naphthyridin-1-yl)quinolin-2-amine
CID 132587462
N-[(2S)-1-morpholin-4-ylpropan-2-yl]-6-(8-pyridin-4-ylimidazo[4,5-c][1,7]naphthyridin-1-yl)quinolin-2-amine
CID 134146432
N-(1-morpholin-4-ylpropan-2-yl)-6-(8-pyridin-4-ylimidazo[4,5-c][1,7]naphthyridin-1-yl)quinolin-2-amine
CID 134149230
5-[2,6-bis[(3S)-3-methylmorpholin-4-yl]-7H-purin-8-yl]-1,3-dihydrobenzimidazol-2-one;(3S)-4-[2-(4,4-difluoropiperidin-1-yl)-8-(1H-indol-4-yl)-7H-purin-6-yl]-3-methylmorpholine
CID 88925583
9-[amino-[2-(3-fluorophenyl)-8-morpholin-4-ylquinolin-3-yl]methyl]-N-[[2-(3-fluorophenyl)-8-morpholin-4-ylquinolin-3-yl]methyl]purin-6-amine
CID 117856210
N-[4-[3-(3,3-difluorocyclobutyl)-7-fluoro-2-methylbenzimidazol-5-yl]-5-fluoropyrimidin-2-yl]-6-[2-(dimethylamino)ethyl]-7,8-dihydro-5H-1,6-naphthyridin-2-amine;6-[2-(dimethylamino)ethyl]-N-[5-fluoro-4-[7-fluoro-2-methyl-3-(oxetan-3-yl)benzimidazol-5-yl]pyrimidin-2-yl]-7,8-dihydro-5H-1,6-naphthyridin-2-amine;N-[5-fluoro-4-[7-fluoro-2-methyl-3-(1-methylazetidin-3-yl)benzimidazol-5-yl]pyrimidin-2-yl]-5,6,7,8-tetrahydro-1,6-naphthyridin-2-amine;N-[5-fluoro-4-[7-fluoro-2-methyl-3-(oxetan-3-yl)benzimidazol-5-yl]pyrimidin-2-yl]-5,6,7,8-tetrahydro-1,6-naphthyridin-2-amine
CID 157498070
4-[2-(5,10-Dimethyl-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-8-yl)ethyl]morpholine;4-[2-(5,10-dimethyl-4,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)ethyl]morpholine;4-[2-(6,11-dimethyl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)ethyl]morpholine;4-[2-(12-fluoro-6,11-dimethyl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaen-8-yl)ethyl]morpholine;methane;4-[2-(6-methyl-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)ethyl]morpholine;8-(2-morpholin-4-ylethyl)-10-(trifluoromethyl)-8,11-diaza-5-azoniatricyclo[7.4.0.02,7]trideca-1,3,6,9,12-pentaene 5-oxide;hydrochloride
CID 157641158
N-[5-[(1-cyclopropylpiperidin-4-ylidene)methyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[[1-(2,2-difluoroethyl)piperidin-4-ylidene]methyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[[1-(2-methoxyethyl)piperidin-4-ylidene]methyl]-2-pyridinyl]pyrimidin-2-amine;2-[4-[[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]methylidene]piperidin-1-yl]ethanol;3-[4-[[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]methylidene]piperidin-1-yl]propan-1-ol;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[[1-(2,2,2-trifluoroethyl)piperidin-4-ylidene]methyl]-2-pyridinyl]pyrimidin-2-amine
CID 158030610
7-benzyl-6-methylidene-2-propoxy-5H-pyrrolo[2,3-d]pyrimidin-4-amine;7-benzyl-6-methylidene-2-(trifluoromethyl)-5H-pyrrolo[2,3-d]pyrimidin-4-amine;8-bromo-2-N-butyl-9-[(4-ethylphenyl)methyl]purine-2,6-diamine;2-N-butyl-9-[(4-ethylphenyl)methyl]purine-2,6-diamine;2-N-butyl-7H-purine-2,6-diamine;3,13-dimethyl-1,9,12-triaza-4-azoniatetracyclo[6.5.2.04,15.011,14]pentadeca-4,6,8(15),9,11(14),12-hexaen-10-amine
CID 158354929
5-(2,2-Difluoroethyl)-7-(6-fluoro-3-pyridinyl)pyrido[4,3-b]indole;8,9-difluoro-7-(6-fluoro-3-pyridinyl)-5-methylpyrido[4,3-b]indole;4-fluoro-7-(6-fluoro-3-pyridinyl)-5-methylpyrido[4,3-b]indole;8-fluoro-7-(6-fluoro-3-pyridinyl)-5-methylpyrido[4,3-b]indole;9-fluoro-7-(6-fluoro-3-pyridinyl)-5-methylpyrido[4,3-b]indole;7-(6-fluoro-3-pyridinyl)-5-(2,2,2-trifluoroethyl)pyrido[4,3-b]indole;2-piperidin-1-ylpyrimido[1,2-a]benzimidazole
CID 158411579
CID 159079625
CID 159079625
7-benzyl-6-methylidene-2-propoxy-5H-pyrrolo[2,3-d]pyrimidin-4-amine;1-benzyl-2-methylidene-6-(trifluoromethyl)-3H-pyrrolo[3,2-c]pyridin-4-amine;2-N-butyl-9-[(4-ethylphenyl)methyl]purine-2,6-diamine;2-N-butyl-6-methylidene-7-[(6-methyl-3-pyridinyl)methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;2-N-butyl-7H-purine-2,6-diamine;3,13-dimethyl-1,9,12-triaza-4-azoniatetracyclo[6.5.2.04,15.011,14]pentadeca-4,6,8(15),9,11(14),12-hexaen-10-amine
CID 159166076

Frequently Asked Questions

What is the IUPAC name of N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride?
The IUPAC name of N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride (CID 167621548) is N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride.
What is the SMILES notation for N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride?
The canonical SMILES for N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride is CC(C)n1ccc2ccc3cnc(Nc4ccc(N5CCC6(CCNCC6)C5)cn4)nc3c21.CC(C)n1ccc2ccc3cnc(Nc4ccc(N5C[C@@H](C)O[C@@H](C)C5)cn4)nc3c21.CC1CN(c2ccc(Nc3ncc4ccc5ccn(C(C)C)c5c4n3)nc2)CCO1.Cc1cc(Nc2ncc3ccc4ccn(C(C)C)c4c3n2)ncc1N1CCOCC1.Cc1nc(Nc2ncc3ccc4ccn(C(C)C)c4c3n2)ccc1N1CCOCC1.Cl.
What is the InChIKey of N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride?
The InChIKey is YDJVMNWXSRPDJI-IXSFNYSNSA-N. The full InChI is InChI=1S/C26H31N7.C24H28N6O.3C23H26N6O.ClH/c1-18(2)33-13-7-19-3-4-20-15-29-25(31-23(20)24(19)33)30-22-6-5-21(16-28-22)32-14-10-26(17-32)8-11-27-12-9-26;1-15(2)30-10-9-18-5-6-19-11-26-24(28-22(19)23(18)30)27-21-8-7-20(12-25-21)29-13-16(3)31-17(4)14-29;1-15(2)29-7-6-17-4-5-18-13-25-23(27-21(18)22(17)29)26-20-12-16(3)19(14-24-20)28-8-10-30-11-9-28;1-15(2)29-9-8-17-4-5-18-14-24-23(27-21(18)22(17)29)26-20-7-6-19(16(3)25-20)28-10-12-30-13-11-28;1-15(2)29-9-8-17-4-5-18-12-25-23(27-21(18)22(17)29)26-20-7-6-19(13-24-20)28-10-11-30-16(3)14-28;/h3-7,13,15-16,18,27H,8-12,14,17H2,1-2H3,(H,28,29,30,31);5-12,15-17H,13-14H2,1-4H3,(H,25,26,27,28);4-7,12-15H,8-11H2,1-3H3,(H,24,25,26,27);4-9,14-15H,10-13H2,1-3H3,(H,24,25,26,27);4-9,12-13,15-16H,10-11,14H2,1-3H3,(H,24,25,26,27);1H/t;16-,17+;;;;.
What are the key properties of N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride?
N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride has a molecular weight of 2102.08 g/mol, XLogP of 23.65, 20 rotatable bonds, 6 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2,8-diazaspiro[4.5]decan-2-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(4-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-[5-(2-methylmorpholin-4-yl)-2-pyridinyl]-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;N-(6-methyl-5-morpholin-4-yl-2-pyridinyl)-9-propan-2-ylpyrrolo[3,2-h]quinazolin-2-amine;hydrochloride is sourced from PubChem (CID 167621548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).