6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide

C18H18N4O2 — CID 91767901

IUPAC6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide
SMILESN#Cc1ccc(C(=O)NC(Cc2ccncc2)C2CC(O)C2)cn1
InChIInChI=1S/C18H18N4O2/c19-10-15-2-1-13(11-21-15)18(24)22-17(14-8-16(23)9-14)7-12-3-5-20-6-4-12/h1-6,11,14,16-17,23H,7-9H2,(H,22,24)
InChIKeyYNGMESUZXWJTIX-UHFFFAOYSA-N
MW322.37 g/mol
LogP1.46
Rot. Bonds5

About 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide

6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide (PubChem CID 91767901) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide
PubChem CID91767901
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide
SMILESN#Cc1ccc(C(=O)NC(Cc2ccncc2)C2CC(O)C2)cn1
InChIInChI=1S/C18H18N4O2/c19-10-15-2-1-13(11-21-15)18(24)22-17(14-8-16(23)9-14)7-12-3-5-20-6-4-12/h1-6,11,14,16-17,23H,7-9H2,(H,22,24)
InChIKeyYNGMESUZXWJTIX-UHFFFAOYSA-N
XLogP1.46
TPSA98.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-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

Hydroxyethylamine-based inhibitor 6
CID 6539258
N-[(4S,5S,7R)-5-hydroxy-2,9-dimethyl-7-(methylcarbamoyl)decan-4-yl]quinoline-3-carboxamide
CID 12015739
Synthesis of N-[(2S)-2-hydroxypropyl]-4-{[2-phenyl-5-(propan-2-yl)pyridin-4-yl]amino} pyridine-3-carboxamide
CID 118211223
US10494376, Example 72
CID 118929796
N-[(2S)-2-hydroxypropyl]-4-{[2-phenyl-5-(propan-2-yl)pyridin-4-yl]amino}pyridine-3-carboxamide
CID 122670024
N-[(3S,4S,5S,7R)-5-hydroxy-3,9-dimethyl-7-(methylcarbamoyl)decan-4-yl]quinoline-3-carboxamide
CID 44308837
N-[(2S,3S)-1-cyclohexyl-3-hydroxy-6-(methylamino)-6-oxohexan-2-yl]quinoline-3-carboxamide
CID 44308850
N-((1S,2S,4R)-1-Benzyl-2-hydroxy-6-methyl-4-methylcarbamoyl-heptyl)-nicotinamide
CID 44309094
N-(3-hydroxy-2,2-dimethylpropyl)-6-phenyl-5-pyridin-4-ylpyridine-3-carboxamide
CID 172435497
Myxochelin N
CID 169492434
N-[(1R)-1-(3-hydroxycyclobutyl)-2-pyridin-2-ylethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 100026985
US10494376, Example 78
CID 118929900

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide?
The IUPAC name of 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide (CID 91767901) is 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide is N#Cc1ccc(C(=O)NC(Cc2ccncc2)C2CC(O)C2)cn1.
What is the InChIKey of 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide?
The InChIKey is YNGMESUZXWJTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c19-10-15-2-1-13(11-21-15)18(24)22-17(14-8-16(23)9-14)7-12-3-5-20-6-4-12/h1-6,11,14,16-17,23H,7-9H2,(H,22,24).
What are the key properties of 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide?
6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide has a molecular weight of 322.37 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide is sourced from PubChem (CID 91767901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).