2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide

C11H20N4O3S — CID 103951288

IUPAC2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide
SMILESCCc1nn(C)cc1NC(=O)C(N)CCS(C)(=O)=O
InChIInChI=1S/C11H20N4O3S/c1-4-9-10(7-15(2)14-9)13-11(16)8(12)5-6-19(3,17)18/h7-8H,4-6,12H2,1-3H3,(H,13,16)
InChIKeyOIQJIUZPHWYUDG-UHFFFAOYSA-N
MW288.37 g/mol
LogP-0.32
Rot. Bonds6

About 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide

2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide (PubChem CID 103951288) has the molecular formula C11H20N4O3S and a molecular weight of 288.37 g/mol. Its IUPAC name is 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide.

Molecular Properties

Compound Name2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide
PubChem CID103951288
Molecular FormulaC11H20N4O3S
Molecular Weight288.37 g/mol
Exact Mass288.13
IUPAC Name2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide
SMILESCCc1nn(C)cc1NC(=O)C(N)CCS(C)(=O)=O
InChIInChI=1S/C11H20N4O3S/c1-4-9-10(7-15(2)14-9)13-11(16)8(12)5-6-19(3,17)18/h7-8H,4-6,12H2,1-3H3,(H,13,16)
InChIKeyOIQJIUZPHWYUDG-UHFFFAOYSA-N
XLogP-0.32
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide 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-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-3-methoxypropanamide
CID 107463127
2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbutanamide
CID 107463141
3-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-2-methylbutanamide
CID 107463044
2-(aminomethyl)-N-(3-ethyl-1-methylpyrazol-4-yl)-4,4-dimethylpentanamide
CID 107473003
2-[(3-ethyl-1-methylpyrazol-4-yl)carbamoyl]-3,3-dimethylbutanoic acid
CID 107464409
2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)ethanesulfonamide
CID 107462576
4-amino-N-(3-ethyl-1-methylpyrazol-4-yl)benzamide
CID 113369006
3-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-3-sulfanylidenepropanamide
CID 107463267
2-amino-4-methylsulfonyl-N-(2,4,5-trichlorophenyl)butanamide
CID 43097188
(3-ethyl-1-methylpyrazol-4-yl)thiourea
CID 107462555
3-[(3-ethyl-1-methylpyrazol-4-yl)carbamoyl-propan-2-ylamino]propanoic acid
CID 107464100
(2R)-2-[(3-ethyl-1-methylpyrazol-4-yl)carbamoylamino]butanedioic acid
CID 107464180

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide?
The IUPAC name of 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide (CID 103951288) is 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide.
What is the SMILES notation for 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide?
The canonical SMILES for 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide is CCc1nn(C)cc1NC(=O)C(N)CCS(C)(=O)=O.
What is the InChIKey of 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide?
The InChIKey is OIQJIUZPHWYUDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3S/c1-4-9-10(7-15(2)14-9)13-11(16)8(12)5-6-19(3,17)18/h7-8H,4-6,12H2,1-3H3,(H,13,16).
What are the key properties of 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide?
2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide has a molecular weight of 288.37 g/mol, XLogP of -0.32, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-4-methylsulfonylbutanamide is sourced from PubChem (CID 103951288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).