1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide

C18H21N3O3S — CID 119283953

IUPAC1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2cccc(S(=O)(=O)Nc3ccccc3)c2)CCCC1
InChIInChI=1S/C18H21N3O3S/c19-18(11-4-5-12-18)17(22)20-15-9-6-10-16(13-15)25(23,24)21-14-7-2-1-3-8-14/h1-3,6-10,13,21H,4-5,11-12,19H2,(H,20,22)
InChIKeySBWMKWMWAGYUFM-UHFFFAOYSA-N
MW359.45 g/mol
LogP2.70
Rot. Bonds5

About 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide

1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide (PubChem CID 119283953) has the molecular formula C18H21N3O3S and a molecular weight of 359.45 g/mol. Its IUPAC name is 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide
PubChem CID119283953
Molecular FormulaC18H21N3O3S
Molecular Weight359.45 g/mol
Exact Mass359.13
IUPAC Name1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2cccc(S(=O)(=O)Nc3ccccc3)c2)CCCC1
InChIInChI=1S/C18H21N3O3S/c19-18(11-4-5-12-18)17(22)20-15-9-6-10-16(13-15)25(23,24)21-14-7-2-1-3-8-14/h1-3,6-10,13,21H,4-5,11-12,19H2,(H,20,22)
InChIKeySBWMKWMWAGYUFM-UHFFFAOYSA-N
XLogP2.70
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.45
LogP ≤ 52.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-[3-(benzenesulfonamido)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119282587
1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119293957
1-amino-N-[3-(butan-2-ylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119341523
1-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119341551
3-[(1-aminocyclohexanecarbonyl)amino]benzoic acid
CID 61157848
1-amino-N-[3-[[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]sulfamoyl]phenyl]cyclopropane-1-carboxamide
CID 57448487
1-amino-N-(benzenesulfonyl)cyclohexane-1-carboxamide
CID 103308699
1-amino-N-[3-(sulfamoylmethyl)phenyl]cyclohexane-1-carboxamide
CID 119308071
1-amino-N-[3-(sulfamoylmethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119308070
1-amino-N-phenylcyclopropane-1-carboxamide;hydrochloride
CID 75467843
1-amino-N-[3-(2-methylpropanoylamino)phenyl]cyclopentane-1-carboxamide
CID 60854804
1-amino-N-[3-(propan-2-ylsulfonylmethyl)phenyl]cyclopentane-1-carboxamide
CID 119324028

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide (CID 119283953) is 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide is NC1(C(=O)Nc2cccc(S(=O)(=O)Nc3ccccc3)c2)CCCC1.
What is the InChIKey of 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide?
The InChIKey is SBWMKWMWAGYUFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3S/c19-18(11-4-5-12-18)17(22)20-15-9-6-10-16(13-15)25(23,24)21-14-7-2-1-3-8-14/h1-3,6-10,13,21H,4-5,11-12,19H2,(H,20,22).
What are the key properties of 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide?
1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide has a molecular weight of 359.45 g/mol, XLogP of 2.70, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119283953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).