N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide

C18H26N6O — CID 70773988

IUPACN-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
SMILESCn1cc(CN(C(=O)C2NCCc3[nH]cnc32)C2CCCCC2)cn1
InChIInChI=1S/C18H26N6O/c1-23-10-13(9-22-23)11-24(14-5-3-2-4-6-14)18(25)17-16-15(7-8-19-17)20-12-21-16/h9-10,12,14,17,19H,2-8,11H2,1H3,(H,20,21)
InChIKeyKIRXHNVTPMRFBW-UHFFFAOYSA-N
MW342.45 g/mol
LogP1.69
Rot. Bonds4

About N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide

N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide (PubChem CID 70773988) has the molecular formula C18H26N6O and a molecular weight of 342.45 g/mol. Its IUPAC name is N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
PubChem CID70773988
Molecular FormulaC18H26N6O
Molecular Weight342.45 g/mol
Exact Mass342.22
IUPAC NameN-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide
SMILESCn1cc(CN(C(=O)C2NCCc3[nH]cnc32)C2CCCCC2)cn1
InChIInChI=1S/C18H26N6O/c1-23-10-13(9-22-23)11-24(14-5-3-2-4-6-14)18(25)17-16-15(7-8-19-17)20-12-21-16/h9-10,12,14,17,19H,2-8,11H2,1H3,(H,20,21)
InChIKeyKIRXHNVTPMRFBW-UHFFFAOYSA-N
XLogP1.69
TPSA78.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.45
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide?
The IUPAC name of N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide (CID 70773988) is N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide is Cn1cc(CN(C(=O)C2NCCc3[nH]cnc32)C2CCCCC2)cn1.
What is the InChIKey of N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide?
The InChIKey is KIRXHNVTPMRFBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N6O/c1-23-10-13(9-22-23)11-24(14-5-3-2-4-6-14)18(25)17-16-15(7-8-19-17)20-12-21-16/h9-10,12,14,17,19H,2-8,11H2,1H3,(H,20,21).
What are the key properties of N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide?
N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide has a molecular weight of 342.45 g/mol, XLogP of 1.69, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxamide is sourced from PubChem (CID 70773988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).