2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide

C11H19N3O — CID 60767988

IUPAC2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide
SMILESCCCC(C)C(=O)NCc1cn[nH]c1C
InChIInChI=1S/C11H19N3O/c1-4-5-8(2)11(15)12-6-10-7-13-14-9(10)3/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14)
InChIKeyCZJRGVXQGPORPZ-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.77
Rot. Bonds5

About 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide

2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide (PubChem CID 60767988) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide.

Molecular Properties

Compound Name2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide
PubChem CID60767988
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide
SMILESCCCC(C)C(=O)NCc1cn[nH]c1C
InChIInChI=1S/C11H19N3O/c1-4-5-8(2)11(15)12-6-10-7-13-14-9(10)3/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14)
InChIKeyCZJRGVXQGPORPZ-UHFFFAOYSA-N
XLogP1.77
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,3,3-trifluoro-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(trifluoromethyl)propanamide
CID 103310272
(2R)-2-amino-3-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]butanamide
CID 79013070
3-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]butanamide
CID 60767372
3-amino-2-methoxy-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide
CID 106112236
(2R)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-thiophen-2-ylpropanamide
CID 99809710
2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentan-1-amine
CID 61004070
2-amino-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide
CID 54896815
(2R)-4-methyl-2-[(5-methyl-1H-pyrazol-4-yl)methylcarbamoylamino]pentanoic acid
CID 78976359
2-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]-4-oxo-2-propan-2-ylbutanoic acid
CID 54896845
4-hydroxy-2-[(5-methyl-1H-pyrazol-4-yl)methylcarbamoylamino]butanoic acid
CID 54982041
2,3,4,5,6-pentamethyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide
CID 61003845
N-[(5-methyl-1H-pyrazol-4-yl)methyl]but-2-ynamide
CID 107989822

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide?
The IUPAC name of 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide (CID 60767988) is 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide.
What is the SMILES notation for 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide?
The canonical SMILES for 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide is CCCC(C)C(=O)NCc1cn[nH]c1C.
What is the InChIKey of 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide?
The InChIKey is CZJRGVXQGPORPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-5-8(2)11(15)12-6-10-7-13-14-9(10)3/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14).
What are the key properties of 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide?
2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide has a molecular weight of 209.29 g/mol, XLogP of 1.77, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pentanamide is sourced from PubChem (CID 60767988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).