N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide

C12H15N5O2S — CID 861385

IUPACN-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide
SMILESO=S(=O)(NC1CCCC1)c1ccc(-n2cnnn2)cc1
InChIInChI=1S/C12H15N5O2S/c18-20(19,14-10-3-1-2-4-10)12-7-5-11(6-8-12)17-9-13-15-16-17/h5-10,14H,1-4H2
InChIKeyFSEWKZWFSRFHLD-UHFFFAOYSA-N
MW293.35 g/mol
LogP0.88
Rot. Bonds4

About N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide

N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide (PubChem CID 861385) has the molecular formula C12H15N5O2S and a molecular weight of 293.35 g/mol. Its IUPAC name is N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide
PubChem CID861385
Molecular FormulaC12H15N5O2S
Molecular Weight293.35 g/mol
Exact Mass293.09
IUPAC NameN-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide
SMILESO=S(=O)(NC1CCCC1)c1ccc(-n2cnnn2)cc1
InChIInChI=1S/C12H15N5O2S/c18-20(19,14-10-3-1-2-4-10)12-7-5-11(6-8-12)17-9-13-15-16-17/h5-10,14H,1-4H2
InChIKeyFSEWKZWFSRFHLD-UHFFFAOYSA-N
XLogP0.88
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide?
The IUPAC name of N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide (CID 861385) is N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide.
What is the SMILES notation for N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide?
The canonical SMILES for N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide is O=S(=O)(NC1CCCC1)c1ccc(-n2cnnn2)cc1.
What is the InChIKey of N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide?
The InChIKey is FSEWKZWFSRFHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2S/c18-20(19,14-10-3-1-2-4-10)12-7-5-11(6-8-12)17-9-13-15-16-17/h5-10,14H,1-4H2.
What are the key properties of N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide?
N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide has a molecular weight of 293.35 g/mol, XLogP of 0.88, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(tetrazol-1-yl)benzenesulfonamide is sourced from PubChem (CID 861385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).