1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline

C94H89N23O5 — CID 158648942

IUPAC1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline
SMILESCC(=O)C1=C(c2ccccc2)CC(c2ccnc(N)n2)=C1.Cc1ccc(-c2cc(-c3ccncc3)[nH]c2-c2nccc3ccccc23)cc1.NC(=O)c1cc(-c2ccnc(N)n2)n(CCO)c1-c1ccccc1.NCCCn1c(-c2ccnc(N)n2)cc(C(N)=O)c1-c1ccccc1.NCCn1c(-c2ccnc(N)n2)cc(C(N)=O)c1-c1ccccc1
InChIInChI=1S/C25H19N3.C18H20N6O.C17H18N6O.C17H17N5O2.C17H15N3O/c1-17-6-8-19(9-7-17)22-16-23(20-10-13-26-14-11-20)28-25(22)24-21-5-3-2-4-18(21)12-15-27-24;19-8-4-10-24-15(14-7-9-22-18(21)23-14)11-13(17(20)25)16(24)12-5-2-1-3-6-12;18-7-9-23-14(13-6-8-21-17(20)22-13)10-12(16(19)24)15(23)11-4-2-1-3-5-11;18-16(24)12-10-14(13-6-7-20-17(19)21-13)22(8-9-23)15(12)11-4-2-1-3-5-11;1-11(21)14-9-13(16-7-8-19-17(18)20-16)10-15(14)12-5-3-2-4-6-12/h2-16,28H,1H3;1-3,5-7,9,11H,4,8,10,19H2,(H2,20,25)(H2,21,22,23);1-6,8,10H,7,9,18H2,(H2,19,24)(H2,20,21,22);1-7,10,23H,8-9H2,(H2,18,24)(H2,19,20,21);2-9H,10H2,1H3,(H2,18,19,20)
InChIKeyIBHRRYMLRCDFQD-UHFFFAOYSA-N
MW1620.90 g/mol
LogP13.34
Rot. Bonds22

About 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline

1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline (PubChem CID 158648942) has the molecular formula C94H89N23O5 and a molecular weight of 1620.90 g/mol. Its IUPAC name is 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline.

Molecular Properties

Compound Name1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline
PubChem CID158648942
Molecular FormulaC94H89N23O5
Molecular Weight1620.90 g/mol
Exact Mass1619.74
IUPAC Name1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline
SMILESCC(=O)C1=C(c2ccccc2)CC(c2ccnc(N)n2)=C1.Cc1ccc(-c2cc(-c3ccncc3)[nH]c2-c2nccc3ccccc23)cc1.NC(=O)c1cc(-c2ccnc(N)n2)n(CCO)c1-c1ccccc1.NCCCn1c(-c2ccnc(N)n2)cc(C(N)=O)c1-c1ccccc1.NCCn1c(-c2ccnc(N)n2)cc(C(N)=O)c1-c1ccccc1
InChIInChI=1S/C25H19N3.C18H20N6O.C17H18N6O.C17H17N5O2.C17H15N3O/c1-17-6-8-19(9-7-17)22-16-23(20-10-13-26-14-11-20)28-25(22)24-21-5-3-2-4-18(21)12-15-27-24;19-8-4-10-24-15(14-7-9-22-18(21)23-14)11-13(17(20)25)16(24)12-5-2-1-3-6-12;18-7-9-23-14(13-6-8-21-17(20)22-13)10-12(16(19)24)15(23)11-4-2-1-3-5-11;18-16(24)12-10-14(13-6-7-20-17(19)21-13)22(8-9-23)15(12)11-4-2-1-3-5-11;1-11(21)14-9-13(16-7-8-19-17(18)20-16)10-15(14)12-5-3-2-4-6-12/h2-16,28H,1H3;1-3,5-7,9,11H,4,8,10,19H2,(H2,20,25)(H2,21,22,23);1-6,8,10H,7,9,18H2,(H2,19,24)(H2,20,21,22);1-7,10,23H,8-9H2,(H2,18,24)(H2,19,20,21);2-9H,10H2,1H3,(H2,18,19,20)
InChIKeyIBHRRYMLRCDFQD-UHFFFAOYSA-N
XLogP13.34
TPSA482.17 Ų
H-Bond Donors11
H-Bond Acceptors24
Rotatable Bonds22
Heavy Atoms122
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001620.90
LogP ≤ 513.34
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1024

Analyze 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline with MolForge

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Related Compounds

(7S)-N-[(3-methylimidazol-3-ium-1-yl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[[2-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-(2-piperidin-1-ylethyl)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-7-propan-2-yl-N-(pyridin-2-ylmethyl)-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-7-propan-2-yl-N-(pyridin-3-ylmethyl)-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide
CID 160465661
2-(3H-benzimidazol-5-ylmethyl)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;2-(2-hydroxyethylamino)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;2-(1H-imidazol-5-ylmethyl)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(4-methylpiperazin-1-yl)benzamide
CID 157212726
3-[(1S)-1-[(5-acetyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-8-methyl-2-phenylisoquinolin-1-one;3-[(1S)-1-[(5-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-8-methyl-2-phenylisoquinolin-1-one;bis(8-methyl-3-[(1S)-1-[(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one);8-methyl-2-phenyl-3-[(1S)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)ethyl]isoquinolin-1-one;sulfane
CID 157414963
bis(1-[2-[3-(dimethylamino)azetidin-1-yl]-4-pyridinyl]-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone);1-[2-[2-(dimethylamino)ethylamino]-4-pyridinyl]-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-[2-(3-methylazetidin-1-yl)-4-pyridinyl]-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[3-(pyrrolidin-1-ylmethyl)phenyl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(2-pyrrolidin-1-yl-4-pyridinyl)ethanone;N-methyl-5-[2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]acetyl]pyridine-2-carboxamide
CID 157758944
6-(anilinomethyl)-4-phenyl-2-pyridin-3-yl-2H-pyridin-3-one;2-[benzyl(1H-imidazol-2-yl)amino]-1-pyridin-3-ylethanone;1-[benzyl(1H-imidazol-2-yl)amino]-3-pyridin-4-ylpropan-2-one;1-[butyl(1H-imidazol-2-yl)amino]-3-phenylpropan-2-one;2-[butyl(1H-imidazol-2-yl)amino]-1-pyridin-3-ylethanone;2-(cyclopenten-1-ylamino)-1-pyridin-3-ylethanone;1-[1H-imidazol-2-yl(pyridin-3-ylmethyl)amino]-3-phenylpropan-2-one
CID 158192030
1-[3-[(dimethylamino)methyl]-1H-indol-6-yl]-2-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]phenyl]ethanone;N-[2-methyl-7-[2-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]phenyl]acetyl]-3,4-dihydro-1H-isoquinolin-4-yl]prop-2-enamide;1-[5-[2-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]phenyl]acetyl]-2,3-dihydroindol-1-yl]prop-2-en-1-one;1-[6-[2-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)methyl]phenyl]acetyl]-3,4-dihydro-2H-quinolin-1-yl]prop-2-en-1-one
CID 158844365
5-(2-aminopyrimidin-4-yl)-1-ethyl-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;4-(2-aminopyrimidin-4-yl)-N-methyl-2-phenylcyclopenta-1,4-diene-1-carboxamide;5-(2-aminopyrimidin-4-yl)-1-methyl-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-5-yl)-1-[2-(oxan-2-yloxy)ethyl]-2-phenylpyrrole-3-carboxamide
CID 159117305
1-[2-[4-(dimethylamino)piperidin-1-yl]-4-pyridinyl]-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;1-[2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-pyridinyl]-2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]ethanone;bis(2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-(2-piperidin-1-yl-4-pyridinyl)ethanone);2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[2-(4-propan-2-ylpiperazin-1-yl)-4-pyridinyl]ethanone;2-[6-(3-methylimidazol-4-yl)isoquinolin-3-yl]-1-[2-(4-propylpiperazin-1-yl)-4-pyridinyl]ethanone
CID 159139391
CID 159225018
CID 159225018
2-Butyl-2,6-diazatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-one;2,6-diazatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-one;2-ethyl-2,6-diazatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-one;methane;2-methyl-2,6-diazatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-one;2-propyl-2,6-diazatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-one;2,4,7-triazatricyclo[7.3.1.05,13]trideca-1(12),2,4,9(13),10-pentaen-8-one
CID 159249876
4-methyl-N-[3-methyl-4-[(4-methylpiperazin-1-yl)methyl]phenyl]-3-[(1-methyl-6-pyridin-4-ylpyrrolo[2,3-b]pyridin-4-yl)amino]benzamide;2-methyl-N-(3-methylphenyl)-5-[(1-methyl-6-pyridin-3-ylpyrrolo[2,3-b]pyridin-4-yl)amino]benzamide;2-methyl-N-(3-methylphenyl)-5-[(1-methyl-6-pyridin-4-ylpyrrolo[2,3-b]pyridin-4-yl)amino]benzamide;1-[3-methyl-4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-[4-methyl-3-[(1-methyl-6-pyridin-4-ylpyrrolo[2,3-b]pyridin-4-yl)amino]phenyl]ethanone
CID 159612224
N'-[4-[[4-amino-6-[[2-amino-1-[2-aminoethyl(ethyl)amino]ethyl]amino]-1,3,5-triazin-2-yl]amino]butyl]-4-[amino-[5-(4-amino-6-ethyl-1,3,5-triazin-2-yl)pentylamino]methyl]benzenecarboximidamide;N-[2-[2-aminoethyl-[2-[[2-(1H-imidazol-5-yl)acetyl]amino]ethyl]amino]ethyl]-9-[5-(4-amino-6-methyl-1,3,5-triazin-2-yl)pentylamino]acridine-2-carboxamide;N-[2-[2-aminoethyl-[2-[[2-(1H-imidazol-5-yl)acetyl]amino]ethyl]amino]ethyl]-9-[5-(4-amino-6-methyl-1,3,5-triazin-2-yl)pentylamino]acridine-4-carboxamide;9-[5-(4-amino-6-methyl-1,3,5-triazin-2-yl)pentylamino]-N-[2-[bis(2-aminoethyl)amino]ethyl]acridine-2-carboxamide;9-[5-(4-amino-6-methyl-1,3,5-triazin-2-yl)pentylamino]-N-[2-[bis(2-aminoethyl)amino]ethyl]acridine-4-carboxamide
CID 159614927

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline?
The IUPAC name of 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline (CID 158648942) is 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline.
What is the SMILES notation for 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline?
The canonical SMILES for 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline is CC(=O)C1=C(c2ccccc2)CC(c2ccnc(N)n2)=C1.Cc1ccc(-c2cc(-c3ccncc3)[nH]c2-c2nccc3ccccc23)cc1.NC(=O)c1cc(-c2ccnc(N)n2)n(CCO)c1-c1ccccc1.NCCCn1c(-c2ccnc(N)n2)cc(C(N)=O)c1-c1ccccc1.NCCn1c(-c2ccnc(N)n2)cc(C(N)=O)c1-c1ccccc1.
What is the InChIKey of 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline?
The InChIKey is IBHRRYMLRCDFQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N3.C18H20N6O.C17H18N6O.C17H17N5O2.C17H15N3O/c1-17-6-8-19(9-7-17)22-16-23(20-10-13-26-14-11-20)28-25(22)24-21-5-3-2-4-18(21)12-15-27-24;19-8-4-10-24-15(14-7-9-22-18(21)23-14)11-13(17(20)25)16(24)12-5-2-1-3-6-12;18-7-9-23-14(13-6-8-21-17(20)22-13)10-12(16(19)24)15(23)11-4-2-1-3-5-11;18-16(24)12-10-14(13-6-7-20-17(19)21-13)22(8-9-23)15(12)11-4-2-1-3-5-11;1-11(21)14-9-13(16-7-8-19-17(18)20-16)10-15(14)12-5-3-2-4-6-12/h2-16,28H,1H3;1-3,5-7,9,11H,4,8,10,19H2,(H2,20,25)(H2,21,22,23);1-6,8,10H,7,9,18H2,(H2,19,24)(H2,20,21,22);1-7,10,23H,8-9H2,(H2,18,24)(H2,19,20,21);2-9H,10H2,1H3,(H2,18,19,20).
What are the key properties of 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline?
1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline has a molecular weight of 1620.90 g/mol, XLogP of 13.34, 22 rotatable bonds, 11 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;1-(3-aminopropyl)-5-(2-aminopyrimidin-4-yl)-2-phenylpyrrole-3-carboxamide;5-(2-aminopyrimidin-4-yl)-1-(2-hydroxyethyl)-2-phenylpyrrole-3-carboxamide;1-[4-(2-aminopyrimidin-4-yl)-2-phenylcyclopenta-1,4-dien-1-yl]ethanone;1-[3-(4-methylphenyl)-5-pyridin-4-yl-1H-pyrrol-2-yl]isoquinoline is sourced from PubChem (CID 158648942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).