N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide

C15H22N2O3S — CID 34737287

IUPACN-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide
SMILESC[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)C1CCCC1
InChIInChI=1S/C15H22N2O3S/c1-11(17(2)15(18)13-5-3-4-6-13)12-7-9-14(10-8-12)21(16,19)20/h7-11,13H,3-6H2,1-2H3,(H2,16,19,20)/t11-/m1/s1
InChIKeyKDOPEDQQQZORCO-LLVKDONJSA-N
MW310.42 g/mol
LogP2.04
Rot. Bonds4

About N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide

N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide (PubChem CID 34737287) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide
PubChem CID34737287
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide
SMILESC[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)C1CCCC1
InChIInChI=1S/C15H22N2O3S/c1-11(17(2)15(18)13-5-3-4-6-13)12-7-9-14(10-8-12)21(16,19)20/h7-11,13H,3-6H2,1-2H3,(H2,16,19,20)/t11-/m1/s1
InChIKeyKDOPEDQQQZORCO-LLVKDONJSA-N
XLogP2.04
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]cyclobutanecarboxamide
CID 34737269
N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]cyclohex-3-ene-1-carboxamide
CID 46635383
N-[1-(4-bromophenyl)ethyl]-N-methylcyclopropanecarboxamide
CID 163259808
N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]butanamide
CID 47141179
4-amino-N-[1-(4-chlorophenyl)ethyl]-N-methylcyclohexane-1-carboxamide
CID 60939297
4-[1-[[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-methylamino]ethyl]benzenesulfonamide
CID 55412916
4-iodo-N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
CID 42919716
N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
CID 46635530
3-amino-N-[1-(4-chlorophenyl)ethyl]-N-methylcyclohexane-1-carboxamide;hydrochloride
CID 119717417
N-methyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 51650990
N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119275393
3-(3,3-diphenylpropyl)-1-methyl-1-[1-(4-sulfamoylphenyl)ethyl]urea
CID 43074821

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide?
The IUPAC name of N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide (CID 34737287) is N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide.
What is the SMILES notation for N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide?
The canonical SMILES for N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide is C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)C1CCCC1.
What is the InChIKey of N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide?
The InChIKey is KDOPEDQQQZORCO-LLVKDONJSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-11(17(2)15(18)13-5-3-4-6-13)12-7-9-14(10-8-12)21(16,19)20/h7-11,13H,3-6H2,1-2H3,(H2,16,19,20)/t11-/m1/s1.
What are the key properties of N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide?
N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide has a molecular weight of 310.42 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]cyclopentanecarboxamide is sourced from PubChem (CID 34737287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).