2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide

C9H17ClN2O3S — CID 107651092

IUPAC2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide
SMILESNC(=O)CN(C1CCCC1)S(=O)(=O)CCCl
InChIInChI=1S/C9H17ClN2O3S/c10-5-6-16(14,15)12(7-9(11)13)8-3-1-2-4-8/h8H,1-7H2,(H2,11,13)
InChIKeyKTWJWSJNRHJNGK-UHFFFAOYSA-N
MW268.77 g/mol
LogP0.28
Rot. Bonds6

About 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide

2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide (PubChem CID 107651092) has the molecular formula C9H17ClN2O3S and a molecular weight of 268.77 g/mol. Its IUPAC name is 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide.

Molecular Properties

Compound Name2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide
PubChem CID107651092
Molecular FormulaC9H17ClN2O3S
Molecular Weight268.77 g/mol
Exact Mass268.06
IUPAC Name2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide
SMILESNC(=O)CN(C1CCCC1)S(=O)(=O)CCCl
InChIInChI=1S/C9H17ClN2O3S/c10-5-6-16(14,15)12(7-9(11)13)8-3-1-2-4-8/h8H,1-7H2,(H2,11,13)
InChIKeyKTWJWSJNRHJNGK-UHFFFAOYSA-N
XLogP0.28
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.77
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide 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-[2-chloroprop-2-enylsulfonyl(cyclopentyl)amino]acetamide
CID 91652020
3-chloro-N-cyclopentyl-N-(2-hydroxyethyl)propane-1-sulfonamide
CID 60958952
2-[cyclohexyl(methyl)amino]acetamide
CID 22200523
2-[cyclopentyl(pyrrolidin-3-ylsulfonyl)amino]acetamide
CID 65420484
2-[2-ethoxyethylsulfonyl(piperidin-4-yl)amino]acetamide
CID 63246713
2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonyl-cyclopentylamino]acetamide
CID 64606928
2-[(4-bromophenyl)sulfonyl-cyclohexylamino]acetamide
CID 1167474
N-(2-chloroethyl)-N-cyclopentyl-2-methoxyethanesulfonamide
CID 63396598
2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide
CID 61108815
2-amino-N-cyclobutyl-N-(2-hydroxyethyl)ethanesulfonamide
CID 102861399
2-[cyclohexyl(ethylsulfonyl)amino]acetic acid
CID 50849243
2-[cyclopentyl(3,3-dimethylbutylsulfonyl)amino]ethanimidamide
CID 103522003

Frequently Asked Questions

What is the IUPAC name of 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide?
The IUPAC name of 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide (CID 107651092) is 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide.
What is the SMILES notation for 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide?
The canonical SMILES for 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide is NC(=O)CN(C1CCCC1)S(=O)(=O)CCCl.
What is the InChIKey of 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide?
The InChIKey is KTWJWSJNRHJNGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17ClN2O3S/c10-5-6-16(14,15)12(7-9(11)13)8-3-1-2-4-8/h8H,1-7H2,(H2,11,13).
What are the key properties of 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide?
2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide has a molecular weight of 268.77 g/mol, XLogP of 0.28, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-chloroethylsulfonyl(cyclopentyl)amino]acetamide is sourced from PubChem (CID 107651092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).