N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide

C14H23N3O — CID 113257957

IUPACN-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide
SMILESCCC1(CNC(=O)c2c(C)n[nH]c2C)CCCC1
InChIInChI=1S/C14H23N3O/c1-4-14(7-5-6-8-14)9-15-13(18)12-10(2)16-17-11(12)3/h4-9H2,1-3H3,(H,15,18)(H,16,17)
InChIKeyFMZBELSUSGEXPO-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.73
Rot. Bonds4

About N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide

N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide (PubChem CID 113257957) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide
PubChem CID113257957
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide
SMILESCCC1(CNC(=O)c2c(C)n[nH]c2C)CCCC1
InChIInChI=1S/C14H23N3O/c1-4-14(7-5-6-8-14)9-15-13(18)12-10(2)16-17-11(12)3/h4-9H2,1-3H3,(H,15,18)(H,16,17)
InChIKeyFMZBELSUSGEXPO-UHFFFAOYSA-N
XLogP2.73
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-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

Related Compounds

N-[(1-ethylcyclobutyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 113252802
2-[1-[[(3,5-dimethyl-1H-pyrazole-4-carbonyl)amino]methyl]cyclobutyl]acetic acid
CID 81163599
3,5-dimethyl-N-propyl-1H-pyrazole-4-carboxamide
CID 43582292
3,5-dimethyl-N-(2-methylbutyl)-1H-pyrazole-4-carboxamide
CID 62691865
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
CID 115362374
N-(2-amino-2-ethylbutyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 113283180
N-[(1-ethylcyclopropyl)methyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 103737261
N-(2,2-diethoxyethyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 79547804
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 107854505
3-[(3,5-dimethyl-1H-pyrazole-4-carbonyl)amino]-2,2-dimethylpropanoic acid
CID 115427297
3-[(3,5-dimethyl-1H-pyrazole-4-carbonyl)amino]-2-methylpropanoic acid
CID 62675345
N-[(1,1-dioxothiolan-3-yl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 54914774

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide?
The IUPAC name of N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide (CID 113257957) is N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide is CCC1(CNC(=O)c2c(C)n[nH]c2C)CCCC1.
What is the InChIKey of N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide?
The InChIKey is FMZBELSUSGEXPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-4-14(7-5-6-8-14)9-15-13(18)12-10(2)16-17-11(12)3/h4-9H2,1-3H3,(H,15,18)(H,16,17).
What are the key properties of N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide?
N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide has a molecular weight of 249.36 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclopentyl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 113257957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).