1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide

C13H13ClN2O2S — CID 2988708

IUPAC1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1Cl)NCc1ccccn1
InChIInChI=1S/C13H13ClN2O2S/c14-13-7-2-1-5-11(13)10-19(17,18)16-9-12-6-3-4-8-15-12/h1-8,16H,9-10H2
InChIKeyFCVCODKLDZFJJN-UHFFFAOYSA-N
MW296.78 g/mol
LogP2.35
Rot. Bonds5

About 1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide

1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide (PubChem CID 2988708) has the molecular formula C13H13ClN2O2S and a molecular weight of 296.78 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide
PubChem CID2988708
Molecular FormulaC13H13ClN2O2S
Molecular Weight296.78 g/mol
Exact Mass296.04
IUPAC Name1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1Cl)NCc1ccccn1
InChIInChI=1S/C13H13ClN2O2S/c14-13-7-2-1-5-11(13)10-19(17,18)16-9-12-6-3-4-8-15-12/h1-8,16H,9-10H2
InChIKeyFCVCODKLDZFJJN-UHFFFAOYSA-N
XLogP2.35
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.78
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2-chlorophenyl)methylsulfonyl]-4-methyl-N-(pyridin-2-ylmethyl)-1,3-thiazol-2-amine
CID 123661730
1-(2-chlorophenyl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]methanesulfonamide
CID 110739043
1-(2-chlorophenyl)-N-pyridin-4-ylmethanesulfonamide
CID 3944658
1-(2-chlorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]methanesulfonamide
CID 75518571
1-(2-chlorophenyl)-N-(2-methylpropyl)methanesulfonamide
CID 17257571
1-(2-chlorophenyl)-N-[(2,5-difluorophenyl)methyl]methanesulfonamide
CID 110780996
1-(2-chlorophenyl)-N-[(2,4-difluorophenyl)methyl]methanesulfonamide
CID 110782254
2,3-dichloro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 47104213
3-[(2-chlorophenyl)methyl]-2-oxo-N-(pyridin-2-ylmethyl)-1,3-benzothiazole-6-sulfonamide
CID 100754606
5-chloro-2-fluoro-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 110759353
[3-[(2-chlorophenyl)methylsulfonylmethyl]-2-pyridinyl]methanamine
CID 103291310
2-(4-benzylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)ethanesulfonamide
CID 169225222

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide?
The IUPAC name of 1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide (CID 2988708) is 1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide.
What is the SMILES notation for 1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide?
The canonical SMILES for 1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide is O=S(=O)(Cc1ccccc1Cl)NCc1ccccn1.
What is the InChIKey of 1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide?
The InChIKey is FCVCODKLDZFJJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2O2S/c14-13-7-2-1-5-11(13)10-19(17,18)16-9-12-6-3-4-8-15-12/h1-8,16H,9-10H2.
What are the key properties of 1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide?
1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide has a molecular weight of 296.78 g/mol, XLogP of 2.35, 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-(pyridin-2-ylmethyl)methanesulfonamide is sourced from PubChem (CID 2988708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).