5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide

C14H21N3O — CID 46578014

IUPAC5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide
SMILESCC1CCCCC1NC(=O)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C14H21N3O/c1-9-4-2-3-5-11(9)15-14(18)13-8-12(16-17-13)10-6-7-10/h8-11H,2-7H2,1H3,(H,15,18)(H,16,17)
InChIKeyJPMURRCEBNLVSY-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.60
Rot. Bonds3

About 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide

5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide (PubChem CID 46578014) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide
PubChem CID46578014
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide
SMILESCC1CCCCC1NC(=O)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C14H21N3O/c1-9-4-2-3-5-11(9)15-14(18)13-8-12(16-17-13)10-6-7-10/h8-11H,2-7H2,1H3,(H,15,18)(H,16,17)
InChIKeyJPMURRCEBNLVSY-UHFFFAOYSA-N
XLogP2.60
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 19590906
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CID 47158112
N-cyclopropyl-5-(oxan-4-yl)-1H-pyrazole-3-carboxamide
CID 166264435
5-methyl-N-[(1R,2R)-2-methylcyclohexyl]pyrazine-2-carboxamide
CID 2677173
5-cyclopropyl-N-[(1R,2S)-2-(3-fluorophenyl)cyclopropyl]-1H-pyrazole-3-carboxamide
CID 99784094
5-cyclopropyl-N-(1-hydroxypropan-2-yl)-1H-pyrazole-3-carboxamide
CID 146085389
5-cyclopropyl-N-[2-(methylamino)ethyl]-1H-pyrazole-3-carboxamide;hydrochloride
CID 119500515
5-cyclopropyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-1H-pyrazole-3-carboxamide
CID 94179713
N-[(1R,2R)-2-methylcyclohexyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 8889054
3,5-diamino-N-(2-methylcyclohexyl)benzamide
CID 61090027
1-N,4-N-bis[(1S,2R)-2-methylcyclohexyl]benzene-1,4-dicarboxamide
CID 124805645
4-amino-N-(2-methylcyclohexyl)pyridine-2-carboxamide
CID 62155915

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide (CID 46578014) is 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide is CC1CCCCC1NC(=O)c1cc(C2CC2)[nH]n1.
What is the InChIKey of 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide?
The InChIKey is JPMURRCEBNLVSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-9-4-2-3-5-11(9)15-14(18)13-8-12(16-17-13)10-6-7-10/h8-11H,2-7H2,1H3,(H,15,18)(H,16,17).
What are the key properties of 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide?
5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 46578014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).