7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide

C17H16N2O2S — CID 769963

IUPAC7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide
SMILESCc1ccc2ccc(S(=O)(=O)NCc3ccccn3)cc2c1
InChIInChI=1S/C17H16N2O2S/c1-13-5-6-14-7-8-17(11-15(14)10-13)22(20,21)19-12-16-4-2-3-9-18-16/h2-11,19H,12H2,1H3
InChIKeyITIGMTIZUOUHDU-UHFFFAOYSA-N
MW312.39 g/mol
LogP3.02
Rot. Bonds4

About 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide

7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide (PubChem CID 769963) has the molecular formula C17H16N2O2S and a molecular weight of 312.39 g/mol. Its IUPAC name is 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide.

Molecular Properties

Compound Name7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide
PubChem CID769963
Molecular FormulaC17H16N2O2S
Molecular Weight312.39 g/mol
Exact Mass312.09
IUPAC Name7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide
SMILESCc1ccc2ccc(S(=O)(=O)NCc3ccccn3)cc2c1
InChIInChI=1S/C17H16N2O2S/c1-13-5-6-14-7-8-17(11-15(14)10-13)22(20,21)19-12-16-4-2-3-9-18-16/h2-11,19H,12H2,1H3
InChIKeyITIGMTIZUOUHDU-UHFFFAOYSA-N
XLogP3.02
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-Isoquinolinylsulfonyl)-2-Methylpiperazine
CID 3542
N-(2-(Methylamino)ethyl)-5-isoquinolinesulfonamide
CID 3540
4-Methyl-N-pyridin-2-ylmethyl-benzenesulfonamide
CID 731623
iso-H 7
CID 1352
9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
CID 16759925
4-(3-Quinolinyl)-Benzenesulfonamide
CID 122707123
5-{[(2S)-2-methylpiperazin-1-yl]sulfonyl}isoquinoline
CID 449240
4-[4-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenyl]-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 24884859
2,3,5,6-tetramethyl-N-pyridin-3-ylbenzenesulfonamide
CID 842946
3-{1-[(2,3,4-Trimethylphenyl)sulfonyl]piperidin-2-yl}pyridine
CID 4563535
2,4,5-trimethyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 802956
2,3,4-trimethyl-N-(4-pyridinylmethyl)benzenesulfonamide
CID 1080609

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide?
The IUPAC name of 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide (CID 769963) is 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide.
What is the SMILES notation for 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide?
The canonical SMILES for 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide is Cc1ccc2ccc(S(=O)(=O)NCc3ccccn3)cc2c1.
What is the InChIKey of 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide?
The InChIKey is ITIGMTIZUOUHDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2S/c1-13-5-6-14-7-8-17(11-15(14)10-13)22(20,21)19-12-16-4-2-3-9-18-16/h2-11,19H,12H2,1H3.
What are the key properties of 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide?
7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide has a molecular weight of 312.39 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-(pyridin-2-ylmethyl)naphthalene-2-sulfonamide is sourced from PubChem (CID 769963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).