N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide

C12H16N2O3S — CID 113093569

IUPACN-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1N(C1CC1)S(C)(=O)=O
InChIInChI=1S/C12H16N2O3S/c1-9(15)13-11-5-3-4-6-12(11)14(10-7-8-10)18(2,16)17/h3-6,10H,7-8H2,1-2H3,(H,13,15)
InChIKeyREWGNOPFZSCSDM-UHFFFAOYSA-N
MW268.34 g/mol
LogP1.57
Rot. Bonds4

About N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide

N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide (PubChem CID 113093569) has the molecular formula C12H16N2O3S and a molecular weight of 268.34 g/mol. Its IUPAC name is N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide
PubChem CID113093569
Molecular FormulaC12H16N2O3S
Molecular Weight268.34 g/mol
Exact Mass268.09
IUPAC NameN-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1N(C1CC1)S(C)(=O)=O
InChIInChI=1S/C12H16N2O3S/c1-9(15)13-11-5-3-4-6-12(11)14(10-7-8-10)18(2,16)17/h3-6,10H,7-8H2,1-2H3,(H,13,15)
InChIKeyREWGNOPFZSCSDM-UHFFFAOYSA-N
XLogP1.57
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-3-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]urea
CID 113093625
N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]-2-(2-methylphenyl)acetamide
CID 113093621
N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]-3,4-dimethylbenzamide
CID 113093595
N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]-3-methylbenzenesulfonamide
CID 113093650
N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]-4-fluoro-3-methylbenzenesulfonamide
CID 113093646
N-[2-[cyclopropyl(methylsulfonyl)amino]-5-fluorophenyl]-2-(3-methylphenyl)acetamide
CID 113093287
N-[2-(dimethylamino)phenyl]-1-methylsulfonylpiperidine-4-carboxamide
CID 30875404
N-[4-[methylsulfonyl(oxan-4-yl)amino]phenyl]acetamide
CID 113094432
N-[2-[formyl(methyl)amino]phenyl]acetamide
CID 130011413
(2-acetamidophenyl) N-cyclohexyl-N-methylsulfamate
CID 37231729
(3S)-3-methyl-N-[2-[methyl(methylsulfonyl)amino]phenyl]azepane-1-carboxamide
CID 124619545
N-cyclopropyl-N-[2-[(4-methoxyphenyl)sulfonylamino]phenyl]acetamide
CID 113093946

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide?
The IUPAC name of N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide (CID 113093569) is N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide.
What is the SMILES notation for N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide?
The canonical SMILES for N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide is CC(=O)Nc1ccccc1N(C1CC1)S(C)(=O)=O.
What is the InChIKey of N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide?
The InChIKey is REWGNOPFZSCSDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3S/c1-9(15)13-11-5-3-4-6-12(11)14(10-7-8-10)18(2,16)17/h3-6,10H,7-8H2,1-2H3,(H,13,15).
What are the key properties of N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide?
N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide has a molecular weight of 268.34 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopropyl(methylsulfonyl)amino]phenyl]acetamide is sourced from PubChem (CID 113093569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).