2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide

C10H6ClF2N3O2S — CID 43456351

IUPAC2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide
SMILESO=S(=O)(Nc1cc(F)cc(F)c1)c1cnc(Cl)nc1
InChIInChI=1S/C10H6ClF2N3O2S/c11-10-14-4-9(5-15-10)19(17,18)16-8-2-6(12)1-7(13)3-8/h1-5,16H
InChIKeyDVDWZYOVBMAKBH-UHFFFAOYSA-N
MW305.69 g/mol
LogP2.21
Rot. Bonds3

About 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide

2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide (PubChem CID 43456351) has the molecular formula C10H6ClF2N3O2S and a molecular weight of 305.69 g/mol. Its IUPAC name is 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide
PubChem CID43456351
Molecular FormulaC10H6ClF2N3O2S
Molecular Weight305.69 g/mol
Exact Mass304.98
IUPAC Name2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide
SMILESO=S(=O)(Nc1cc(F)cc(F)c1)c1cnc(Cl)nc1
InChIInChI=1S/C10H6ClF2N3O2S/c11-10-14-4-9(5-15-10)19(17,18)16-8-2-6(12)1-7(13)3-8/h1-5,16H
InChIKeyDVDWZYOVBMAKBH-UHFFFAOYSA-N
XLogP2.21
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.69
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(3,5-dimethylphenyl)pyrimidine-5-sulfonamide
CID 43456340
2-chloro-N-(2,3,5-trifluorophenyl)pyrimidine-5-sulfonamide
CID 62813531
2-chloro-N-(4-chloro-3-cyanophenyl)pyrimidine-5-sulfonamide
CID 61053173
N-(6-bromo-3-pyridinyl)-2-chloropyrimidine-5-sulfonamide
CID 114051668
N-(5-bromo-6-chloro-3-pyridinyl)-3,5-difluorobenzenesulfonamide
CID 104826709
3-chloro-N-(3,5-difluorophenyl)-4-methylbenzenesulfonamide
CID 47309744
3-[(2-chloropyrimidin-5-yl)sulfonylamino]benzamide
CID 61053533
4-[(2-chloropyrimidin-5-yl)sulfonylamino]benzamide
CID 43456434
3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 113259712
N-(4-bromo-2,6-dichlorophenyl)-2-chloropyrimidine-5-sulfonamide
CID 43456516
5-chloro-N-(3,5-difluorophenyl)-1-methylimidazole-4-sulfonamide
CID 43415229
2-chloro-N-(2-methylpropyl)pyrimidine-5-sulfonamide
CID 43456284

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide?
The IUPAC name of 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide (CID 43456351) is 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide?
The canonical SMILES for 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide is O=S(=O)(Nc1cc(F)cc(F)c1)c1cnc(Cl)nc1.
What is the InChIKey of 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide?
The InChIKey is DVDWZYOVBMAKBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClF2N3O2S/c11-10-14-4-9(5-15-10)19(17,18)16-8-2-6(12)1-7(13)3-8/h1-5,16H.
What are the key properties of 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide?
2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide has a molecular weight of 305.69 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3,5-difluorophenyl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 43456351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).