N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide

C157H162N24O26 — CID 159254127

IUPACN-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
SMILESCOc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OC(C)C(N)=O)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OC[C@@H]1CCCN1)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OC[C@@H]1CCCN1Cc1ccccc1)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3C)cc1OC(C)C(N)=O)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3C)cc1OCc1ccccn1)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3C)cc1Oc1cccnc1)CO2
InChIInChI=1S/C32H34N4O4.C27H26N4O4.C26H24N4O4.C25H28N4O4.C24H26N4O5.C23H24N4O5/c1-38-28-10-12-30-24(15-28)14-25(20-39-30)32(37)35-29-11-9-23(26-17-33-34-18-26)16-31(29)40-21-27-8-5-13-36(27)19-22-6-3-2-4-7-22;1-17-23(14-29-31-17)18-6-8-24(26(13-18)35-16-21-5-3-4-10-28-21)30-27(32)20-11-19-12-22(33-2)7-9-25(19)34-15-20;1-16-22(14-28-30-16)17-5-7-23(25(12-17)34-21-4-3-9-27-13-21)29-26(31)19-10-18-11-20(32-2)6-8-24(18)33-15-19;1-31-21-5-7-23-17(10-21)9-18(14-32-23)25(30)29-22-6-4-16(19-12-27-28-13-19)11-24(22)33-15-20-3-2-8-26-20;1-13-19(11-26-28-13)15-4-6-20(22(10-15)33-14(2)23(25)29)27-24(30)17-8-16-9-18(31-3)5-7-21(16)32-12-17;1-13(22(24)28)32-21-9-14(17-10-25-26-11-17)3-5-19(21)27-23(29)16-7-15-8-18(30-2)4-6-20(15)31-12-16/h2-4,6-7,9-12,15-18,25,27H,5,8,13-14,19-21H2,1H3,(H,33,34)(H,35,37);3-10,12-14,20H,11,15-16H2,1-2H3,(H,29,31)(H,30,32);3-9,11-14,19H,10,15H2,1-2H3,(H,28,30)(H,29,31);4-7,10-13,18,20,26H,2-3,8-9,14-15H2,1H3,(H,27,28)(H,29,30);4-7,9-11,14,17H,8,12H2,1-3H3,(H2,25,29)(H,26,28)(H,27,30);3-6,8-11,13,16H,7,12H2,1-2H3,(H2,24,28)(H,25,26)(H,27,29)/t25?,27-;;;18?,20-;;/m0..0../s1
InChIKeyKVRFOJBNAZTMOB-DJTGJNHASA-N
MW2801.16 g/mol
LogP23.42
Rot. Bonds43

About N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide

N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide (PubChem CID 159254127) has the molecular formula C157H162N24O26 and a molecular weight of 2801.16 g/mol. Its IUPAC name is N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide.

Molecular Properties

Compound NameN-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
PubChem CID159254127
Molecular FormulaC157H162N24O26
Molecular Weight2801.16 g/mol
Exact Mass2799.21
IUPAC NameN-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
SMILESCOc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OC(C)C(N)=O)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OC[C@@H]1CCCN1)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OC[C@@H]1CCCN1Cc1ccccc1)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3C)cc1OC(C)C(N)=O)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3C)cc1OCc1ccccn1)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3C)cc1Oc1cccnc1)CO2
InChIInChI=1S/C32H34N4O4.C27H26N4O4.C26H24N4O4.C25H28N4O4.C24H26N4O5.C23H24N4O5/c1-38-28-10-12-30-24(15-28)14-25(20-39-30)32(37)35-29-11-9-23(26-17-33-34-18-26)16-31(29)40-21-27-8-5-13-36(27)19-22-6-3-2-4-7-22;1-17-23(14-29-31-17)18-6-8-24(26(13-18)35-16-21-5-3-4-10-28-21)30-27(32)20-11-19-12-22(33-2)7-9-25(19)34-15-20;1-16-22(14-28-30-16)17-5-7-23(25(12-17)34-21-4-3-9-27-13-21)29-26(31)19-10-18-11-20(32-2)6-8-24(18)33-15-19;1-31-21-5-7-23-17(10-21)9-18(14-32-23)25(30)29-22-6-4-16(19-12-27-28-13-19)11-24(22)33-15-20-3-2-8-26-20;1-13-19(11-26-28-13)15-4-6-20(22(10-15)33-14(2)23(25)29)27-24(30)17-8-16-9-18(31-3)5-7-21(16)32-12-17;1-13(22(24)28)32-21-9-14(17-10-25-26-11-17)3-5-19(21)27-23(29)16-7-15-8-18(30-2)4-6-20(15)31-12-16/h2-4,6-7,9-12,15-18,25,27H,5,8,13-14,19-21H2,1H3,(H,33,34)(H,35,37);3-10,12-14,20H,11,15-16H2,1-2H3,(H,29,31)(H,30,32);3-9,11-14,19H,10,15H2,1-2H3,(H,28,30)(H,29,31);4-7,10-13,18,20,26H,2-3,8-9,14-15H2,1H3,(H,27,28)(H,29,30);4-7,9-11,14,17H,8,12H2,1-3H3,(H2,25,29)(H,26,28)(H,27,30);3-6,8-11,13,16H,7,12H2,1-2H3,(H2,24,28)(H,25,26)(H,27,29)/t25?,27-;;;18?,20-;;/m0..0../s1
InChIKeyKVRFOJBNAZTMOB-DJTGJNHASA-N
XLogP23.42
TPSA640.05 Ų
H-Bond Donors15
H-Bond Acceptors36
Rotatable Bonds43
Heavy Atoms207
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002801.16
LogP ≤ 523.42
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1036

Analyze N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide with MolForge

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Related Compounds

(3S)-N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
CID 124566166
6-methoxy-N-[2-(1-methylpiperidin-3-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[2-(1-methylpiperidin-3-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-3-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[2-phenoxy-4-(1H-pyrazol-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 160664917
(3S)-6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 124566182
(3S)-6-methoxy-N-[2-[[(2S)-1-methylpiperidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 124566120
6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 58310791
(3R)-6-methoxy-N-[2-(2-phenylmethoxyethoxy)-4-(1H-pyrazol-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 124566310
(3R)-N-[2-[3-(dimethylamino)propoxy]-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
CID 124566085
(3S)-N-[2-[3-(dimethylamino)phenoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
CID 124566168
6-methoxy-N-[2-(oxolan-2-ylmethoxy)-4-(1H-pyrazol-4-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;2,2,2-trifluoroacetic acid
CID 117077248
N-[2-(3-acetamidophenoxy)-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;2,2,2-trifluoroacetic acid
CID 117077148
N-[2-(2-aminoethoxy)-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 117075809
4-[2-[(6-methoxy-3,4-dihydro-2H-chromene-3-carbonyl)amino]-5-(1H-pyrazol-4-yl)phenoxy]piperidine-1-carboxylic acid
CID 123423770

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide?
The IUPAC name of N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide (CID 159254127) is N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide.
What is the SMILES notation for N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide?
The canonical SMILES for N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide is COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OC(C)C(N)=O)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OC[C@@H]1CCCN1)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OC[C@@H]1CCCN1Cc1ccccc1)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3C)cc1OC(C)C(N)=O)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3C)cc1OCc1ccccn1)CO2.COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3C)cc1Oc1cccnc1)CO2.
What is the InChIKey of N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide?
The InChIKey is KVRFOJBNAZTMOB-DJTGJNHASA-N. The full InChI is InChI=1S/C32H34N4O4.C27H26N4O4.C26H24N4O4.C25H28N4O4.C24H26N4O5.C23H24N4O5/c1-38-28-10-12-30-24(15-28)14-25(20-39-30)32(37)35-29-11-9-23(26-17-33-34-18-26)16-31(29)40-21-27-8-5-13-36(27)19-22-6-3-2-4-7-22;1-17-23(14-29-31-17)18-6-8-24(26(13-18)35-16-21-5-3-4-10-28-21)30-27(32)20-11-19-12-22(33-2)7-9-25(19)34-15-20;1-16-22(14-28-30-16)17-5-7-23(25(12-17)34-21-4-3-9-27-13-21)29-26(31)19-10-18-11-20(32-2)6-8-24(18)33-15-19;1-31-21-5-7-23-17(10-21)9-18(14-32-23)25(30)29-22-6-4-16(19-12-27-28-13-19)11-24(22)33-15-20-3-2-8-26-20;1-13-19(11-26-28-13)15-4-6-20(22(10-15)33-14(2)23(25)29)27-24(30)17-8-16-9-18(31-3)5-7-21(16)32-12-17;1-13(22(24)28)32-21-9-14(17-10-25-26-11-17)3-5-19(21)27-23(29)16-7-15-8-18(30-2)4-6-20(15)31-12-16/h2-4,6-7,9-12,15-18,25,27H,5,8,13-14,19-21H2,1H3,(H,33,34)(H,35,37);3-10,12-14,20H,11,15-16H2,1-2H3,(H,29,31)(H,30,32);3-9,11-14,19H,10,15H2,1-2H3,(H,28,30)(H,29,31);4-7,10-13,18,20,26H,2-3,8-9,14-15H2,1H3,(H,27,28)(H,29,30);4-7,9-11,14,17H,8,12H2,1-3H3,(H2,25,29)(H,26,28)(H,27,30);3-6,8-11,13,16H,7,12H2,1-2H3,(H2,24,28)(H,25,26)(H,27,29)/t25?,27-;;;18?,20-;;/m0..0../s1.
What are the key properties of N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide?
N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide has a molecular weight of 2801.16 g/mol, XLogP of 23.42, 43 rotatable bonds, 15 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(5-methyl-1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-(1-amino-1-oxopropan-2-yl)oxy-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;N-[2-[[(2S)-1-benzylpyrrolidin-2-yl]methoxy]-4-(1H-pyrazol-4-yl)phenyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-(pyridin-2-ylmethoxy)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(5-methyl-1H-pyrazol-4-yl)-2-pyridin-3-yloxyphenyl]-3,4-dihydro-2H-chromene-3-carboxamide;6-methoxy-N-[4-(1H-pyrazol-4-yl)-2-[[(2S)-pyrrolidin-2-yl]methoxy]phenyl]-3,4-dihydro-2H-chromene-3-carboxamide is sourced from PubChem (CID 159254127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).