N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide

C11H17N3O — CID 43532977

IUPACN-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide
SMILESCC1CCC(NC(=O)c2cn[nH]c2)CC1
InChIInChI=1S/C11H17N3O/c1-8-2-4-10(5-3-8)14-11(15)9-6-12-13-7-9/h6-8,10H,2-5H2,1H3,(H,12,13)(H,14,15)
InChIKeyDVKLDAZXFNHXOC-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.72
Rot. Bonds2

About N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide

N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide (PubChem CID 43532977) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide
PubChem CID43532977
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide
SMILESCC1CCC(NC(=O)c2cn[nH]c2)CC1
InChIInChI=1S/C11H17N3O/c1-8-2-4-10(5-3-8)14-11(15)9-6-12-13-7-9/h6-8,10H,2-5H2,1H3,(H,12,13)(H,14,15)
InChIKeyDVKLDAZXFNHXOC-UHFFFAOYSA-N
XLogP1.72
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1H-pyrazole-4-carboxamide
CID 43582334
1-(1H-pyrazole-4-carbonyl)piperidin-4-amine
CID 43565570
N-{[1-(dimethylamino)cyclohexyl]methyl}-1H-pyrazole-4-carboxamide
CID 61249302
N-({trans-4-[(methylamino)carbonyl]cyclohexyl}methyl)-1H-pyrazole-4-carboxamide
CID 77082666
1-{3-[(1H-pyrazol-4-ylcarbonyl)amino]propyl}piperidine-4-carboxamide
CID 91834090
N-(4,4-difluorocyclohexyl)-1H-pyrazole-4-carboxamide
CID 122160170
2-(1H-pyrazol-4-ylcarbonyl)-2-azaspiro[4.4]nonane
CID 124205376
N-methyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]-1H-pyrazole-4-carboxamide
CID 125526617
N-(5-fluoro-2-adamantyl)-1H-pyrazole-4-carboxamide
CID 141184157
N-(cyclohexylmethyl)-1H-pyrazole-4-carboxamide
CID 6734414
N-[4-(trifluoromethyl)cyclohexyl]-1H-pyrazole-4-carboxamide
CID 60785978
N-[3-(trifluoromethyl)cyclohexyl]-1H-pyrazole-4-carboxamide
CID 60788329

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide (CID 43532977) is N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide is CC1CCC(NC(=O)c2cn[nH]c2)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide?
The InChIKey is DVKLDAZXFNHXOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-2-4-10(5-3-8)14-11(15)9-6-12-13-7-9/h6-8,10H,2-5H2,1H3,(H,12,13)(H,14,15).
What are the key properties of N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide?
N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide has a molecular weight of 207.28 g/mol, XLogP of 1.72, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 43532977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).