N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide

C23H22FN7O2 — CID 167523082

IUPACN-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide
SMILESN#CC(NC(=O)C(CC1CC1)NC(=O)C1Cc2cccc(F)c2N1)c1cncc2[nH]cnc12
InChIInChI=1S/C23H22FN7O2/c24-15-3-1-2-13-7-17(29-20(13)15)23(33)30-16(6-12-4-5-12)22(32)31-18(8-25)14-9-26-10-19-21(14)28-11-27-19/h1-3,9-12,16-18,29H,4-7H2,(H,27,28)(H,30,33)(H,31,32)
InChIKeyGDQXASVEPATCSO-UHFFFAOYSA-N
MW447.47 g/mol
LogP2.10
Rot. Bonds7

About N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide

N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 167523082) has the molecular formula C23H22FN7O2 and a molecular weight of 447.47 g/mol. Its IUPAC name is N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID167523082
Molecular FormulaC23H22FN7O2
Molecular Weight447.47 g/mol
Exact Mass447.18
IUPAC NameN-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide
SMILESN#CC(NC(=O)C(CC1CC1)NC(=O)C1Cc2cccc(F)c2N1)c1cncc2[nH]cnc12
InChIInChI=1S/C23H22FN7O2/c24-15-3-1-2-13-7-17(29-20(13)15)23(33)30-16(6-12-4-5-12)22(32)31-18(8-25)14-9-26-10-19-21(14)28-11-27-19/h1-3,9-12,16-18,29H,4-7H2,(H,27,28)(H,30,33)(H,31,32)
InChIKeyGDQXASVEPATCSO-UHFFFAOYSA-N
XLogP2.10
TPSA135.59 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.47
LogP ≤ 52.10
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-[[cyano(imidazo[1,5-c]pyrimidin-1-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide
CID 167521445
N-[1-[[cyano(1,2,3,4-tetrahydrocinnolin-4-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide
CID 167522964
N-[(2S)-1-[[cyano(1,6-naphthyridin-8-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-1H-indole-2-carboxamide
CID 175899284
N-[1-[[cyano-(5-methyl-1H-imidazol-4-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-3,3-dimethyl-2-[(2,2,2-trifluoroacetyl)amino]butanamide
CID 167522856
N-[4-[[cyano-[4-ethenyl-5-(methylideneamino)-3-pyridinyl]methyl]amino]-3-methyl-4-oxo-1-sulfanylbutyl]-7-fluoro-1H-indole-2-carboxamide
CID 167521469
(2R)-N-[(S)-cyano-(2-fluorophenyl)methyl]-2-methylbutanamide
CID 95617372
N-[1-[(1-cyano-1-pyrazin-2-ylethyl)amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-1H-indole-2-carboxamide
CID 167521456
N-[cyano-(2-fluorophenyl)methyl]cyclopropanecarboxamide
CID 82114013
8-fluoro-1,2,3,4-tetrahydroquinoline-2-carboxamide
CID 105447942
N-[(1R)-1-(2-fluorophenyl)ethyl]-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
CID 81374493
N-[cyano(cyclopropyl)methyl]-2-(2-fluorophenyl)acetamide
CID 63822321
4-chloro-N-[1-[[1-cyano-2-(2-oxopyrrolidin-3-yl)ethyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
CID 170025404

Frequently Asked Questions

What is the IUPAC name of N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide (CID 167523082) is N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide is N#CC(NC(=O)C(CC1CC1)NC(=O)C1Cc2cccc(F)c2N1)c1cncc2[nH]cnc12.
What is the InChIKey of N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is GDQXASVEPATCSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22FN7O2/c24-15-3-1-2-13-7-17(29-20(13)15)23(33)30-16(6-12-4-5-12)22(32)31-18(8-25)14-9-26-10-19-21(14)28-11-27-19/h1-3,9-12,16-18,29H,4-7H2,(H,27,28)(H,30,33)(H,31,32).
What are the key properties of N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide?
N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 447.47 g/mol, XLogP of 2.10, 7 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[[cyano(3H-imidazo[4,5-c]pyridin-7-yl)methyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-7-fluoro-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 167523082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).