N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide

C16H19N5O2 — CID 70020378

IUPACN-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide
SMILESO=C(NC1CCC(NC(=O)n2ccnc2)CC1)c1cccnc1
InChIInChI=1S/C16H19N5O2/c22-15(12-2-1-7-17-10-12)19-13-3-5-14(6-4-13)20-16(23)21-9-8-18-11-21/h1-2,7-11,13-14H,3-6H2,(H,19,22)(H,20,23)
InChIKeyYWLIYLFIMXLTIH-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.58
Rot. Bonds3

About N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide

N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide (PubChem CID 70020378) has the molecular formula C16H19N5O2 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide
PubChem CID70020378
Molecular FormulaC16H19N5O2
Molecular Weight313.36 g/mol
Exact Mass313.15
IUPAC NameN-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide
SMILESO=C(NC1CCC(NC(=O)n2ccnc2)CC1)c1cccnc1
InChIInChI=1S/C16H19N5O2/c22-15(12-2-1-7-17-10-12)19-13-3-5-14(6-4-13)20-16(23)21-9-8-18-11-21/h1-2,7-11,13-14H,3-6H2,(H,19,22)(H,20,23)
InChIKeyYWLIYLFIMXLTIH-UHFFFAOYSA-N
XLogP1.58
TPSA88.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-(imidazole-1-carbonylamino)cyclohexyl]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

N-cyclopentylpyridine-3-carboxamide
CID 805532
N-(4-phenylcyclohexyl)imidazole-1-carboxamide
CID 81257713
N-(4-ethylcyclohexyl)pyridine-3-carboxamide
CID 25237064
N-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 175209394
N-(oxetan-3-yl)pyridine-3-carboxamide
CID 66910448
N-(1-methylsulfonylpiperidin-4-yl)pyridine-3-carboxamide
CID 3218770
N-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]pyridine-3-carboxamide
CID 175648718
phenyl 4-(pyridine-3-carbonylamino)piperidine-1-carboxylate
CID 110821885
N-[1-(5-bromopyrimidin-2-yl)piperidin-4-yl]pyridine-3-carboxamide
CID 175648905
N-[1-(4-pyrrol-1-ylbenzoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47796919
N-[1-(2-chlorobenzoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47797182
N-[1-(benzylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide
CID 47836760

Frequently Asked Questions

What is the IUPAC name of N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide?
The IUPAC name of N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide (CID 70020378) is N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide?
The canonical SMILES for N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide is O=C(NC1CCC(NC(=O)n2ccnc2)CC1)c1cccnc1.
What is the InChIKey of N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide?
The InChIKey is YWLIYLFIMXLTIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O2/c22-15(12-2-1-7-17-10-12)19-13-3-5-14(6-4-13)20-16(23)21-9-8-18-11-21/h1-2,7-11,13-14H,3-6H2,(H,19,22)(H,20,23).
What are the key properties of N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide?
N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide is sourced from PubChem (CID 70020378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).