2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide

C9H16N4O — CID 165486221

IUPAC2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide
SMILESCNC(C(N)=O)C(C)n1cc(C)cn1
InChIInChI=1S/C9H16N4O/c1-6-4-12-13(5-6)7(2)8(11-3)9(10)14/h4-5,7-8,11H,1-3H3,(H2,10,14)
InChIKeyVWSPBVOWHIZXOM-UHFFFAOYSA-N
MW196.25 g/mol
LogP-0.17
Rot. Bonds4

About 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide

2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide (PubChem CID 165486221) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide.

Molecular Properties

Compound Name2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide
PubChem CID165486221
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide
SMILESCNC(C(N)=O)C(C)n1cc(C)cn1
InChIInChI=1S/C9H16N4O/c1-6-4-12-13(5-6)7(2)8(11-3)9(10)14/h4-5,7-8,11H,1-3H3,(H2,10,14)
InChIKeyVWSPBVOWHIZXOM-UHFFFAOYSA-N
XLogP-0.17
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(methylamino)-3-(4-methylpyrazol-1-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

2-[1-(2,2-dimethylpropyl)-3-oxo-2-piperazinyl]-N-[(1-methyl-1H-pyrazol-4-yl)methyl]acetamide
CID 16190577
3-(1-methyl-1H-pyrazol-4-yl)piperazin-2-one
CID 62349814
2-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]butanamide
CID 19290567
2-(4-Bromo-1H-pyrazol-1-yl)-N-propylpropanamide
CID 19537573
2-(4-bromopyrazol-1-yl)-N-[3-(diethylamino)propyl]propanamide
CID 19537737
N-[(1-ethylpyrazol-4-yl)methyl]-3-methylbutanamide
CID 35276265
N-[(1-ethylpyrazol-4-yl)methyl]-2-methylpropanamide
CID 39891826
N-(1-ethylpiperidin-4-yl)-2-[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]acetamide
CID 53623783
N-(2-methylpropyl)-2-[3-(4-methylpyrazol-1-yl)azetidin-1-yl]acetamide
CID 56780732
N,N-dimethyl-2-[4-[1-(1-propan-2-ylpyrazol-4-yl)ethylamino]piperidin-1-yl]acetamide
CID 75428135
N-cyclopropyl-2-[1-(3-methylbutyl)-3-oxo-2-piperazinyl]-N-[(1-methyl-1H-pyrazol-4-yl)methyl]acetamide
CID 56881515
2-(4-bromo-1H-pyrazol-1-yl)-3-methylbutanamide
CID 130748543

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide?
The IUPAC name of 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide (CID 165486221) is 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide.
What is the SMILES notation for 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide?
The canonical SMILES for 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide is CNC(C(N)=O)C(C)n1cc(C)cn1.
What is the InChIKey of 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide?
The InChIKey is VWSPBVOWHIZXOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-6-4-12-13(5-6)7(2)8(11-3)9(10)14/h4-5,7-8,11H,1-3H3,(H2,10,14).
What are the key properties of 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide?
2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide has a molecular weight of 196.25 g/mol, XLogP of -0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-3-(4-methylpyrazol-1-yl)butanamide is sourced from PubChem (CID 165486221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).