2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide

C10H16N4O2 — CID 43429350

IUPAC2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide
SMILESCC(=O)NC(C(=O)Nc1cn[nH]c1)C(C)C
InChIInChI=1S/C10H16N4O2/c1-6(2)9(13-7(3)15)10(16)14-8-4-11-12-5-8/h4-6,9H,1-3H3,(H,11,12)(H,13,15)(H,14,16)
InChIKeyQVSIJMWZKOEKDN-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.51
Rot. Bonds4

About 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide

2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide (PubChem CID 43429350) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide.

Molecular Properties

Compound Name2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide
PubChem CID43429350
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide
SMILESCC(=O)NC(C(=O)Nc1cn[nH]c1)C(C)C
InChIInChI=1S/C10H16N4O2/c1-6(2)9(13-7(3)15)10(16)14-8-4-11-12-5-8/h4-6,9H,1-3H3,(H,11,12)(H,13,15)(H,14,16)
InChIKeyQVSIJMWZKOEKDN-UHFFFAOYSA-N
XLogP0.51
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide 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

1-amino-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide hydrochloride
CID 165469821
N-(1H-pyrazol-4-yl)-1-(3-sulfanylpropanoyl)pyrrolidine-3-carboxamide
CID 177681147
N-(1H-pyrazol-4-yl)-4-(3-sulfanylpropanoylamino)butanamide
CID 177681374
N-methyl-2-[4-(1H-pyrazol-4-ylcarbamoylamino)piperidin-1-yl]acetamide
CID 53503350
3-amino-2-methyl-N-(1H-pyrazol-4-yl)propanamide
CID 54592830
N-(1H-pyrazol-4-yl)pyrrolidine-3-carboxamide
CID 63006229
4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide
CID 71972608
(2S)-2-N,2-N-diethyl-1-N-(1H-pyrazol-4-yl)pyrrolidine-1,2-dicarboxamide
CID 95628337
2-[cyclopropyl(ethyl)amino]-N-(1H-pyrazol-4-yl)acetamide
CID 136517020
5-oxo-N-(1H-pyrazol-4-yl)-1-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 43429719
N-methyl-5-oxo-N-(1H-pyrazol-4-yl)-1-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 75376451
2-amino-3,3,3-trifluoro-2-methyl-N-(1H-pyrazol-4-yl)propanamide
CID 79796623

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide?
The IUPAC name of 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide (CID 43429350) is 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide.
What is the SMILES notation for 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide?
The canonical SMILES for 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide is CC(=O)NC(C(=O)Nc1cn[nH]c1)C(C)C.
What is the InChIKey of 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide?
The InChIKey is QVSIJMWZKOEKDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-6(2)9(13-7(3)15)10(16)14-8-4-11-12-5-8/h4-6,9H,1-3H3,(H,11,12)(H,13,15)(H,14,16).
What are the key properties of 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide?
2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide has a molecular weight of 224.26 g/mol, XLogP of 0.51, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-3-methyl-N-(1H-pyrazol-4-yl)butanamide is sourced from PubChem (CID 43429350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).