N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide

C17H27N3O3S — CID 1460470

IUPACN-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide
SMILESCC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)CNC2CCCC2)cc1
InChIInChI=1S/C17H27N3O3S/c1-3-13(2)20-24(22,23)16-10-8-15(9-11-16)19-17(21)12-18-14-6-4-5-7-14/h8-11,13-14,18,20H,3-7,12H2,1-2H3,(H,19,21)/t13-/m0/s1
InChIKeyXCYWVLORRUNPAS-ZDUSSCGKSA-N
MW353.49 g/mol
LogP2.23
Rot. Bonds8

About N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide

N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide (PubChem CID 1460470) has the molecular formula C17H27N3O3S and a molecular weight of 353.49 g/mol. Its IUPAC name is N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide.

Molecular Properties

Compound NameN-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide
PubChem CID1460470
Molecular FormulaC17H27N3O3S
Molecular Weight353.49 g/mol
Exact Mass353.18
IUPAC NameN-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide
SMILESCC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)CNC2CCCC2)cc1
InChIInChI=1S/C17H27N3O3S/c1-3-13(2)20-24(22,23)16-10-8-15(9-11-16)19-17(21)12-18-14-6-4-5-7-14/h8-11,13-14,18,20H,3-7,12H2,1-2H3,(H,19,21)/t13-/m0/s1
InChIKeyXCYWVLORRUNPAS-ZDUSSCGKSA-N
XLogP2.23
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.49
LogP ≤ 52.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[4-[[(2R)-butan-2-yl]sulfamoyl]anilino]-2-oxoethyl]-cycloheptylazanium
CID 7406873
N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]butanamide
CID 51566560
N-[4-(butan-2-ylsulfamoyl)phenyl]acetamide
CID 3113473
N-[4-[[2-(cyclohexylamino)acetyl]amino]phenyl]-3-methylbutanamide
CID 54816270
N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide
CID 51686284
2-(cyclopentylamino)-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]acetamide
CID 17066641
4-[[(2R)-butan-2-yl]sulfamoyl]-N-cyclopentylbenzamide
CID 9214369
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide
CID 4530095
2-(cyclopentylamino)-N-(4-hydroxyphenyl)acetamide
CID 54918004
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide
CID 43877406
2-(cyclopentylamino)-N-(4-ethoxyphenyl)acetamide
CID 47107212
2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-cycloheptylacetamide
CID 1307702

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide?
The IUPAC name of N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide (CID 1460470) is N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide.
What is the SMILES notation for N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide?
The canonical SMILES for N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide is CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)CNC2CCCC2)cc1.
What is the InChIKey of N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide?
The InChIKey is XCYWVLORRUNPAS-ZDUSSCGKSA-N. The full InChI is InChI=1S/C17H27N3O3S/c1-3-13(2)20-24(22,23)16-10-8-15(9-11-16)19-17(21)12-18-14-6-4-5-7-14/h8-11,13-14,18,20H,3-7,12H2,1-2H3,(H,19,21)/t13-/m0/s1.
What are the key properties of N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide?
N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide has a molecular weight of 353.49 g/mol, XLogP of 2.23, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide is sourced from PubChem (CID 1460470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).