(2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide

C16H24N2O4S — CID 124843343

IUPAC(2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide
SMILESCOC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H24N2O4S/c1-12(11-22-2)16(19)17-13-7-9-15(10-8-13)23(20,21)18-14-5-3-4-6-14/h7-10,12,14,18H,3-6,11H2,1-2H3,(H,17,19)/t12-/m0/s1
InChIKeyDOANBYKJOVGYMU-LBPRGKRZSA-N
MW340.45 g/mol
LogP2.13
Rot. Bonds7

About (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide

(2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide (PubChem CID 124843343) has the molecular formula C16H24N2O4S and a molecular weight of 340.45 g/mol. Its IUPAC name is (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide.

Molecular Properties

Compound Name(2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide
PubChem CID124843343
Molecular FormulaC16H24N2O4S
Molecular Weight340.45 g/mol
Exact Mass340.15
IUPAC Name(2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide
SMILESCOC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H24N2O4S/c1-12(11-22-2)16(19)17-13-7-9-15(10-8-13)23(20,21)18-14-5-3-4-6-14/h7-10,12,14,18H,3-6,11H2,1-2H3,(H,17,19)/t12-/m0/s1
InChIKeyDOANBYKJOVGYMU-LBPRGKRZSA-N
XLogP2.13
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-2-methoxypropanamide
CID 124730678
(3R)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxybutanamide
CID 124843219
(3S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxybutanamide
CID 124843220
methyl N-[4-(cyclohexylsulfamoyl)phenyl]carbamate
CID 6465161
2,2-dichloro-N-[4-(cyclohexylsulfamoyl)phenyl]acetamide
CID 2228727
N-[4-(cyclohexylsulfamoyl)phenyl]-4-(2-methoxyethoxy)benzamide
CID 17353443
N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide
CID 2973953
(2S)-2-amino-N-[4-(cyclopropylsulfamoyl)phenyl]-3-methylbutanamide
CID 61252074
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide
CID 51331716
1-cyclopentyl-3-[4-(cyclopentylsulfamoyl)phenyl]urea
CID 119045085
1-[4-(cyclopentylsulfamoyl)phenyl]-3-cyclopropylurea
CID 119045070
5-bromo-N-[4-(cyclohexylsulfamoyl)phenyl]-2-(2-methoxyethoxy)benzamide
CID 17357163

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide?
The IUPAC name of (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide (CID 124843343) is (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide.
What is the SMILES notation for (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide?
The canonical SMILES for (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide is COC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1.
What is the InChIKey of (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide?
The InChIKey is DOANBYKJOVGYMU-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H24N2O4S/c1-12(11-22-2)16(19)17-13-7-9-15(10-8-13)23(20,21)18-14-5-3-4-6-14/h7-10,12,14,18H,3-6,11H2,1-2H3,(H,17,19)/t12-/m0/s1.
What are the key properties of (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide?
(2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide has a molecular weight of 340.45 g/mol, XLogP of 2.13, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide is sourced from PubChem (CID 124843343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).