1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide

C19H21ClN2O3S — CID 992785

IUPAC1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide
SMILESO=C(c1ccccc1NS(=O)(=O)Cc1ccccc1Cl)N1CCCCC1
InChIInChI=1S/C19H21ClN2O3S/c20-17-10-4-2-8-15(17)14-26(24,25)21-18-11-5-3-9-16(18)19(23)22-12-6-1-7-13-22/h2-5,8-11,21H,1,6-7,12-14H2
InChIKeyQPANMRKQSFRFCJ-UHFFFAOYSA-N
MW392.91 g/mol
LogP3.91
Rot. Bonds5

About 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide

1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide (PubChem CID 992785) has the molecular formula C19H21ClN2O3S and a molecular weight of 392.91 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide
PubChem CID992785
Molecular FormulaC19H21ClN2O3S
Molecular Weight392.91 g/mol
Exact Mass392.10
IUPAC Name1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide
SMILESO=C(c1ccccc1NS(=O)(=O)Cc1ccccc1Cl)N1CCCCC1
InChIInChI=1S/C19H21ClN2O3S/c20-17-10-4-2-8-15(17)14-26(24,25)21-18-11-5-3-9-16(18)19(23)22-12-6-1-7-13-22/h2-5,8-11,21H,1,6-7,12-14H2
InChIKeyQPANMRKQSFRFCJ-UHFFFAOYSA-N
XLogP3.91
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.91
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-chlorophenyl)methylsulfonylamino]-N-cyclohexylbenzamide
CID 17321697
3-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]propanamide
CID 17179010
1-(3,4-dichlorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]methanesulfonamide
CID 134052293
1-(3-nitrophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide
CID 92680035
N-[2-(azepane-1-carbonyl)phenyl]-2-chlorobenzamide
CID 2985638
2-[(2-chlorophenyl)methylsulfonylamino]-N-propylbenzamide
CID 17321694
(3S)-1-[2-(ethylsulfonylamino)benzoyl]piperidine-3-carboxylic acid
CID 119174076
4-[(2-chlorophenyl)methoxy]-N-[2-(piperidine-1-carbonyl)phenyl]benzamide
CID 19916445
N-[2-(3-ethylpiperidine-1-carbonyl)phenyl]ethanesulfonamide
CID 51096518
[4-[(2-chlorophenyl)methylsulfonyl]piperazin-1-yl]-(2-methylphenyl)methanone
CID 110365412
(3S)-1-[(2-chlorophenyl)methyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]piperidine-3-carboxamide
CID 93491921
(3R)-1-[(2-chlorophenyl)methyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]piperidine-3-carboxamide
CID 93491922

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide?
The IUPAC name of 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide (CID 992785) is 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide.
What is the SMILES notation for 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide?
The canonical SMILES for 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide is O=C(c1ccccc1NS(=O)(=O)Cc1ccccc1Cl)N1CCCCC1.
What is the InChIKey of 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide?
The InChIKey is QPANMRKQSFRFCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O3S/c20-17-10-4-2-8-15(17)14-26(24,25)21-18-11-5-3-9-16(18)19(23)22-12-6-1-7-13-22/h2-5,8-11,21H,1,6-7,12-14H2.
What are the key properties of 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide?
1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide has a molecular weight of 392.91 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]methanesulfonamide is sourced from PubChem (CID 992785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).