2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide

C13H21N3O — CID 136526156

IUPAC2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CC2CCC(C)CC2)n[nH]1
InChIInChI=1S/C13H21N3O/c1-9-3-5-11(6-4-9)8-13(17)14-12-7-10(2)15-16-12/h7,9,11H,3-6,8H2,1-2H3,(H2,14,15,16,17)
InChIKeyOKBRLJSDSWWLBW-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.87
Rot. Bonds3

About 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide

2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide (PubChem CID 136526156) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
PubChem CID136526156
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CC2CCC(C)CC2)n[nH]1
InChIInChI=1S/C13H21N3O/c1-9-3-5-11(6-4-9)8-13(17)14-12-7-10(2)15-16-12/h7,9,11H,3-6,8H2,1-2H3,(H2,14,15,16,17)
InChIKeyOKBRLJSDSWWLBW-UHFFFAOYSA-N
XLogP2.87
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-methyl-1H-pyrazol-3-yl)-2-(oxetan-3-yl)acetamide
CID 112524720
2-cyclopentyl-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 115593738
2-cyclobutyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)acetamide
CID 103710671
N-(5-ethyl-1H-pyrazol-3-yl)-4-methylcyclohexane-1-carboxamide
CID 113245552
(5-methyl-1H-pyrazol-3-yl)carbamic acid
CID 23091960
2-cyclohexyloxy-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 47289841
N-(5-methyl-1H-pyrazol-3-yl)cyclooctanecarboxamide
CID 65022914
N-(5-methyl-1H-pyrazol-3-yl)nonanamide
CID 47289748
2-(1-aminocyclobutyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 79853709
3-[(2-cyclohexylacetyl)amino]-N-propyl-1H-pyrazole-5-carboxamide
CID 143192643
2-cyano-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 82668146
2-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 115629912

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide?
The IUPAC name of 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide (CID 136526156) is 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide?
The canonical SMILES for 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide is Cc1cc(NC(=O)CC2CCC(C)CC2)n[nH]1.
What is the InChIKey of 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide?
The InChIKey is OKBRLJSDSWWLBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-9-3-5-11(6-4-9)8-13(17)14-12-7-10(2)15-16-12/h7,9,11H,3-6,8H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide?
2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide has a molecular weight of 235.33 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylcyclohexyl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide is sourced from PubChem (CID 136526156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).