5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide

C10H17N3O — CID 63996997

IUPAC5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide
SMILESCCC(CC)NC(=O)c1cn[nH]c1C
InChIInChI=1S/C10H17N3O/c1-4-8(5-2)12-10(14)9-6-11-13-7(9)3/h6,8H,4-5H2,1-3H3,(H,11,13)(H,12,14)
InChIKeyFAQHGGZZDLKBKD-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.64
Rot. Bonds4

About 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide

5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide (PubChem CID 63996997) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide
PubChem CID63996997
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide
SMILESCCC(CC)NC(=O)c1cn[nH]c1C
InChIInChI=1S/C10H17N3O/c1-4-8(5-2)12-10(14)9-6-11-13-7(9)3/h6,8H,4-5H2,1-3H3,(H,11,13)(H,12,14)
InChIKeyFAQHGGZZDLKBKD-UHFFFAOYSA-N
XLogP1.64
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-chloro-4-methylpentan-2-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 114301001
N-(1-bromopropan-2-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 114310722
N-(4-bromo-1-methoxybutan-2-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 106156313
N-(4-amino-4-oxobutan-2-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 115664810
N-(1-amino-3-methylbutan-2-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 65191454
2-[[(5-methyl-1H-pyrazole-4-carbonyl)amino]methyl]butanoic acid
CID 65218133
N-(1-chloro-4-methylpentan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 106354631
N-(2,2-difluoroethyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 79080022
N-(1-amino-4,4-dimethylpentan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 106357237
N-[(1S)-2-hydroxy-1-phenylethyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 103945112
(2R)-5-amino-2-[(5-methyl-1H-pyrazole-4-carbonyl)amino]-5-oxopentanoic acid
CID 107829870
N-[(1R)-2-(diethylamino)-1-phenylethyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 97212696

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide (CID 63996997) is 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide is CCC(CC)NC(=O)c1cn[nH]c1C.
What is the InChIKey of 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide?
The InChIKey is FAQHGGZZDLKBKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-4-8(5-2)12-10(14)9-6-11-13-7(9)3/h6,8H,4-5H2,1-3H3,(H,11,13)(H,12,14).
What are the key properties of 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide?
5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide has a molecular weight of 195.27 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-pentan-3-yl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 63996997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).