N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide

C17H13N5O2S — CID 2467029

IUPACN-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(-n2cnnn2)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C17H13N5O2S/c23-25(24,17-10-5-13-3-1-2-4-14(13)11-17)19-15-6-8-16(9-7-15)22-12-18-20-21-22/h1-12,19H
InChIKeyFDSSCGIZSOQLGO-UHFFFAOYSA-N
MW351.39 g/mol
LogP2.62
Rot. Bonds4

About N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide

N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide (PubChem CID 2467029) has the molecular formula C17H13N5O2S and a molecular weight of 351.39 g/mol. Its IUPAC name is N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide
PubChem CID2467029
Molecular FormulaC17H13N5O2S
Molecular Weight351.39 g/mol
Exact Mass351.08
IUPAC NameN-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(-n2cnnn2)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C17H13N5O2S/c23-25(24,17-10-5-13-3-1-2-4-14(13)11-17)19-15-6-8-16(9-7-15)22-12-18-20-21-22/h1-12,19H
InChIKeyFDSSCGIZSOQLGO-UHFFFAOYSA-N
XLogP2.62
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.39
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-methyl-5-[[4-(tetrazol-1-yl)phenyl]sulfamoyl]benzoate
CID 7042585
3-chloro-4-methoxy-N-[4-(tetrazol-1-yl)phenyl]benzenesulfonamide
CID 39827484
N-[3,5-bis(trifluoromethyl)phenyl]-4-(tetrazol-1-yl)benzenesulfonamide
CID 166204102
4-(azepan-1-ylsulfonyl)-N-[4-(tetrazol-1-yl)phenyl]benzenesulfonamide
CID 1448327
3-chloro-4-(difluoromethoxy)-N-[4-(tetrazol-1-yl)phenyl]benzenesulfonamide
CID 39827496
2-naphthalen-2-yloxy-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 2579424
N-(4-propan-2-ylphenyl)naphthalene-2-sulfonamide
CID 3997695
N-hydroxy-4-(naphthalen-2-ylsulfonylamino)benzamide
CID 86231375
3-chloro-N-[3-(tetrazol-1-yl)phenyl]benzenesulfonamide
CID 7693123
N-[4-(dimethylsulfamoyl)phenyl]naphthalene-2-sulfonamide
CID 2098625
2,3-dimethyl-5-nitro-N-[4-(tetrazol-1-yl)phenyl]benzenesulfonamide
CID 24510066
4-(2,5-dioxopyrrolidin-1-yl)-N-[3-(tetrazol-1-yl)phenyl]benzenesulfonamide
CID 146021431

Frequently Asked Questions

What is the IUPAC name of N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide?
The IUPAC name of N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide (CID 2467029) is N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide.
What is the SMILES notation for N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide?
The canonical SMILES for N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide is O=S(=O)(Nc1ccc(-n2cnnn2)cc1)c1ccc2ccccc2c1.
What is the InChIKey of N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide?
The InChIKey is FDSSCGIZSOQLGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5O2S/c23-25(24,17-10-5-13-3-1-2-4-14(13)11-17)19-15-6-8-16(9-7-15)22-12-18-20-21-22/h1-12,19H.
What are the key properties of N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide?
N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide has a molecular weight of 351.39 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(tetrazol-1-yl)phenyl]naphthalene-2-sulfonamide is sourced from PubChem (CID 2467029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).