N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide

C15H14ClNO3S — CID 62505094

IUPACN-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)Cc2cccc(Cl)c2)cc1
InChIInChI=1S/C15H14ClNO3S/c1-21(19,20)17-14-7-5-12(6-8-14)15(18)10-11-3-2-4-13(16)9-11/h2-9,17H,10H2,1H3
InChIKeyMEHZWZMYHWXFHB-UHFFFAOYSA-N
MW323.80 g/mol
LogP3.14
Rot. Bonds5

About N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide

N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide (PubChem CID 62505094) has the molecular formula C15H14ClNO3S and a molecular weight of 323.80 g/mol. Its IUPAC name is N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide
PubChem CID62505094
Molecular FormulaC15H14ClNO3S
Molecular Weight323.80 g/mol
Exact Mass323.04
IUPAC NameN-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)Cc2cccc(Cl)c2)cc1
InChIInChI=1S/C15H14ClNO3S/c1-21(19,20)17-14-7-5-12(6-8-14)15(18)10-11-3-2-4-13(16)9-11/h2-9,17H,10H2,1H3
InChIKeyMEHZWZMYHWXFHB-UHFFFAOYSA-N
XLogP3.14
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.80
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[2-(4-chlorophenyl)acetyl]phenyl]methanesulfonamide
CID 43339023
1-[2-(3-chlorophenyl)ethyl]-3-[4-(methanesulfonamido)phenyl]urea
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2-(3-chlorophenyl)-1-(3-methylsulfonylphenyl)ethanone
CID 114962432
[4-(methanesulfonamido)phenyl] 3-(3-chlorophenyl)propanoate
CID 47583628
1-(3-chloro-4-methylphenyl)-2-(3-chlorophenyl)ethanone
CID 63528907
N-[2-(3-chlorophenyl)ethyl]-3-(methanesulfonamido)benzamide
CID 18114724
N-[4-(3-chlorobenzoyl)phenyl]ethanesulfonamide
CID 43339100
N-[3-(4-chlorobenzoyl)phenyl]methanesulfonamide
CID 110427114
4-[[2-(3-chlorophenyl)acetyl]amino]benzamide
CID 56922735
2-(3-chlorophenyl)-N-(4-ethylsulfonylphenyl)acetamide
CID 110778659
3-chloro-N-[4-(2-sulfanylacetyl)phenyl]benzenesulfonamide
CID 87731949
1-(3-chlorophenyl)propan-2-one
CID 2734097

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide?
The IUPAC name of N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide (CID 62505094) is N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide.
What is the SMILES notation for N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide?
The canonical SMILES for N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide is CS(=O)(=O)Nc1ccc(C(=O)Cc2cccc(Cl)c2)cc1.
What is the InChIKey of N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide?
The InChIKey is MEHZWZMYHWXFHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO3S/c1-21(19,20)17-14-7-5-12(6-8-14)15(18)10-11-3-2-4-13(16)9-11/h2-9,17H,10H2,1H3.
What are the key properties of N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide?
N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide has a molecular weight of 323.80 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(3-chlorophenyl)acetyl]phenyl]methanesulfonamide is sourced from PubChem (CID 62505094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).