N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide

C19H18N2O4S — CID 90032034

IUPACN-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide
SMILESCn1cc(-c2cc(NS(C)(=O)=O)ccc2Oc2ccccc2)ccc1=O
InChIInChI=1S/C19H18N2O4S/c1-21-13-14(8-11-19(21)22)17-12-15(20-26(2,23)24)9-10-18(17)25-16-6-4-3-5-7-16/h3-13,20H,1-2H3
InChIKeyCVBOZNMBOJLQFN-UHFFFAOYSA-N
MW370.43 g/mol
LogP3.22
Rot. Bonds5

About N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide

N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide (PubChem CID 90032034) has the molecular formula C19H18N2O4S and a molecular weight of 370.43 g/mol. Its IUPAC name is N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide
PubChem CID90032034
Molecular FormulaC19H18N2O4S
Molecular Weight370.43 g/mol
Exact Mass370.10
IUPAC NameN-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide
SMILESCn1cc(-c2cc(NS(C)(=O)=O)ccc2Oc2ccccc2)ccc1=O
InChIInChI=1S/C19H18N2O4S/c1-21-13-14(8-11-19(21)22)17-12-15(20-26(2,23)24)9-10-18(17)25-16-6-4-3-5-7-16/h3-13,20H,1-2H3
InChIKeyCVBOZNMBOJLQFN-UHFFFAOYSA-N
XLogP3.22
TPSA77.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-[2-(trifluoromethyl)phenoxy]phenyl]methanesulfonamide
CID 90017788
4-[5-(methanesulfonamido)-2-phenoxyphenyl]-6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid
CID 71617223
N-[4-(2,4-difluorophenoxy)-3-(5-methoxy-1-methyl-6-oxo-3-pyridinyl)phenyl]methanesulfonamide
CID 118021474
N-[3-(5-methyl-6-oxo-1H-pyridin-3-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide
CID 90018711
N-[3-(5-ethyl-1-methyl-6-oxo-3-pyridinyl)-4-(3-methylphenoxy)phenyl]ethenesulfonamide
CID 162120668
N-[3-(5-ethyl-1-methyl-6-oxo-3-pyridinyl)-4-(3-ethylphenoxy)phenyl]ethenesulfonamide
CID 163760303
N-[3-(5-ethyl-1-methyl-6-oxo-3-pyridinyl)-4-(4-fluorophenoxy)phenyl]ethenesulfonamide
CID 160859383
methyl N'-[5-(methanesulfonamido)-2-phenoxyphenyl]carbamimidothioate;hydroiodide
CID 70529923
N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-phenoxyphenyl]ethanesulfonamide
CID 139341535
N-(5-methoxy-2-phenoxyphenyl)methanesulfonamide
CID 10803650
4-ethoxy-3-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
CID 118022423
5-[2-(cyclopropylmethoxy)-5-methylsulfonylphenyl]-1-methylpyridin-2-one
CID 118022228

Frequently Asked Questions

What is the IUPAC name of N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide?
The IUPAC name of N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide (CID 90032034) is N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide.
What is the SMILES notation for N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide?
The canonical SMILES for N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide is Cn1cc(-c2cc(NS(C)(=O)=O)ccc2Oc2ccccc2)ccc1=O.
What is the InChIKey of N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide?
The InChIKey is CVBOZNMBOJLQFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4S/c1-21-13-14(8-11-19(21)22)17-12-15(20-26(2,23)24)9-10-18(17)25-16-6-4-3-5-7-16/h3-13,20H,1-2H3.
What are the key properties of N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide?
N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide has a molecular weight of 370.43 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-methyl-6-oxo-3-pyridinyl)-4-phenoxyphenyl]methanesulfonamide is sourced from PubChem (CID 90032034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).