2-cyclopropylsulfonyl-N-methylbutanamide

C8H15NO3S — CID 142793278

IUPAC2-cyclopropylsulfonyl-N-methylbutanamide
SMILESCCC(C(=O)NC)S(=O)(=O)C1CC1
InChIInChI=1S/C8H15NO3S/c1-3-7(8(10)9-2)13(11,12)6-4-5-6/h6-7H,3-5H2,1-2H3,(H,9,10)
InChIKeyUOBCMEYYJMTFJX-UHFFFAOYSA-N
MW205.28 g/mol
LogP0.09
Rot. Bonds4

About 2-cyclopropylsulfonyl-N-methylbutanamide

2-cyclopropylsulfonyl-N-methylbutanamide (PubChem CID 142793278) has the molecular formula C8H15NO3S and a molecular weight of 205.28 g/mol. Its IUPAC name is 2-cyclopropylsulfonyl-N-methylbutanamide.

Molecular Properties

Compound Name2-cyclopropylsulfonyl-N-methylbutanamide
PubChem CID142793278
Molecular FormulaC8H15NO3S
Molecular Weight205.28 g/mol
Exact Mass205.08
IUPAC Name2-cyclopropylsulfonyl-N-methylbutanamide
SMILESCCC(C(=O)NC)S(=O)(=O)C1CC1
InChIInChI=1S/C8H15NO3S/c1-3-7(8(10)9-2)13(11,12)6-4-5-6/h6-7H,3-5H2,1-2H3,(H,9,10)
InChIKeyUOBCMEYYJMTFJX-UHFFFAOYSA-N
XLogP0.09
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropylsulfonyl-N-methylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropylsulfonyl-N-methylbutanamide?
The IUPAC name of 2-cyclopropylsulfonyl-N-methylbutanamide (CID 142793278) is 2-cyclopropylsulfonyl-N-methylbutanamide.
What is the SMILES notation for 2-cyclopropylsulfonyl-N-methylbutanamide?
The canonical SMILES for 2-cyclopropylsulfonyl-N-methylbutanamide is CCC(C(=O)NC)S(=O)(=O)C1CC1.
What is the InChIKey of 2-cyclopropylsulfonyl-N-methylbutanamide?
The InChIKey is UOBCMEYYJMTFJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3S/c1-3-7(8(10)9-2)13(11,12)6-4-5-6/h6-7H,3-5H2,1-2H3,(H,9,10).
What are the key properties of 2-cyclopropylsulfonyl-N-methylbutanamide?
2-cyclopropylsulfonyl-N-methylbutanamide has a molecular weight of 205.28 g/mol, XLogP of 0.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylsulfonyl-N-methylbutanamide is sourced from PubChem (CID 142793278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).