N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide

C15H22N2O3S — CID 107182878

IUPACN,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide
SMILESCN(C(=O)C1CCCC1(C)C)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C15H22N2O3S/c1-15(2)10-4-5-13(15)14(18)17(3)11-6-8-12(9-7-11)21(16,19)20/h6-9,13H,4-5,10H2,1-3H3,(H2,16,19,20)
InChIKeyDOJBHMJKEAKRPY-UHFFFAOYSA-N
MW310.42 g/mol
LogP2.12
Rot. Bonds3

About N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide

N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide (PubChem CID 107182878) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide
PubChem CID107182878
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide
SMILESCN(C(=O)C1CCCC1(C)C)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C15H22N2O3S/c1-15(2)10-4-5-13(15)14(18)17(3)11-6-8-12(9-7-11)21(16,19)20/h6-9,13H,4-5,10H2,1-3H3,(H2,16,19,20)
InChIKeyDOJBHMJKEAKRPY-UHFFFAOYSA-N
XLogP2.12
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide?
The IUPAC name of N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide (CID 107182878) is N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide is CN(C(=O)C1CCCC1(C)C)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide?
The InChIKey is DOJBHMJKEAKRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-15(2)10-4-5-13(15)14(18)17(3)11-6-8-12(9-7-11)21(16,19)20/h6-9,13H,4-5,10H2,1-3H3,(H2,16,19,20).
What are the key properties of N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide?
N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide has a molecular weight of 310.42 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 107182878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).