N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide

C19H19NO3S — CID 2496333

IUPACN-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide
SMILESCOc1ccccc1[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C19H19NO3S/c1-14(18-9-5-6-10-19(18)23-2)20-24(21,22)17-12-11-15-7-3-4-8-16(15)13-17/h3-14,20H,1-2H3/t14-/m0/s1
InChIKeyPXGAWJHNUWQSAX-AWEZNQCLSA-N
MW341.43 g/mol
LogP3.89
Rot. Bonds5

About N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide

N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide (PubChem CID 2496333) has the molecular formula C19H19NO3S and a molecular weight of 341.43 g/mol. Its IUPAC name is N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide
PubChem CID2496333
Molecular FormulaC19H19NO3S
Molecular Weight341.43 g/mol
Exact Mass341.11
IUPAC NameN-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide
SMILESCOc1ccccc1[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C19H19NO3S/c1-14(18-9-5-6-10-19(18)23-2)20-24(21,22)17-12-11-15-7-3-4-8-16(15)13-17/h3-14,20H,1-2H3/t14-/m0/s1
InChIKeyPXGAWJHNUWQSAX-AWEZNQCLSA-N
XLogP3.89
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-4-methoxy-N-[1-(2-methoxyphenyl)ethyl]benzenesulfonamide
CID 133202669
3-ethyl-4-methoxy-N-[1-(2-methoxyphenyl)ethyl]benzenesulfonamide
CID 133219535
4-chloro-N-[1-(2-methoxyphenyl)ethyl]benzenesulfonamide
CID 18083064
N-[1-(2-methoxyphenyl)ethyl]-4-(trifluoromethoxy)benzenesulfonamide
CID 4828145
methyl 5-[[(1S)-1-(2-methoxyphenyl)ethyl]sulfamoyl]-2-methylbenzoate
CID 100763986
N-[1-(2,5-dimethoxyphenyl)ethyl]-4-methoxy-3-propan-2-ylbenzenesulfonamide
CID 133178714
3,4-dimethoxy-N-[1-(2-methylphenyl)ethyl]benzenesulfonamide
CID 51169554
methyl 3-[[(1S)-1-(2-methoxyphenyl)ethyl]sulfamoyl]benzoate
CID 31760778
N-[1-(2-methoxyphenyl)ethyl]-3-methyl-2-oxo-1,3-benzothiazole-6-sulfonamide
CID 133230873
N-[(1S)-1-(2-methoxyphenyl)ethyl]-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide
CID 40798724
6-chloro-N-[(1S)-1-(2-methoxyphenyl)ethyl]pyridine-3-sulfonamide
CID 7510094
N-[(1R)-1-(2-methoxyphenyl)ethyl]methanesulfonamide
CID 28560460

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide?
The IUPAC name of N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide (CID 2496333) is N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide.
What is the SMILES notation for N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide?
The canonical SMILES for N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide is COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide?
The InChIKey is PXGAWJHNUWQSAX-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H19NO3S/c1-14(18-9-5-6-10-19(18)23-2)20-24(21,22)17-12-11-15-7-3-4-8-16(15)13-17/h3-14,20H,1-2H3/t14-/m0/s1.
What are the key properties of N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide?
N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide has a molecular weight of 341.43 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(2-methoxyphenyl)ethyl]naphthalene-2-sulfonamide is sourced from PubChem (CID 2496333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).