N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide

C14H20N2O3S — CID 934846

IUPACN-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide
SMILESCCN(CC(=O)NC1CC1)S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C14H20N2O3S/c1-3-16(10-14(17)15-12-6-7-12)20(18,19)13-8-4-11(2)5-9-13/h4-5,8-9,12H,3,6-7,10H2,1-2H3,(H,15,17)
InChIKeyNNUSMRUDWCJDOL-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.28
Rot. Bonds6

About N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide

N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide (PubChem CID 934846) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide
PubChem CID934846
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC NameN-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide
SMILESCCN(CC(=O)NC1CC1)S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C14H20N2O3S/c1-3-16(10-14(17)15-12-6-7-12)20(18,19)13-8-4-11(2)5-9-13/h4-5,8-9,12H,3,6-7,10H2,1-2H3,(H,15,17)
InChIKeyNNUSMRUDWCJDOL-UHFFFAOYSA-N
XLogP1.28
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide (CID 934846) is N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide is CCN(CC(=O)NC1CC1)S(=O)(=O)c1ccc(C)cc1.
What is the InChIKey of N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide?
The InChIKey is NNUSMRUDWCJDOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-3-16(10-14(17)15-12-6-7-12)20(18,19)13-8-4-11(2)5-9-13/h4-5,8-9,12H,3,6-7,10H2,1-2H3,(H,15,17).
What are the key properties of N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide?
N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide has a molecular weight of 296.39 g/mol, XLogP of 1.28, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 934846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).