N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide

C16H21ClN2O4S — CID 4012245

IUPACN-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide
SMILESO=C(Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1)C1CCCC1
InChIInChI=1S/C16H21ClN2O4S/c17-14-6-5-13(18-16(20)12-3-1-2-4-12)11-15(14)24(21,22)19-7-9-23-10-8-19/h5-6,11-12H,1-4,7-10H2,(H,18,20)
InChIKeyDRVRPFJXZRHFSN-UHFFFAOYSA-N
MW372.87 g/mol
LogP2.49
Rot. Bonds4

About N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide

N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide (PubChem CID 4012245) has the molecular formula C16H21ClN2O4S and a molecular weight of 372.87 g/mol. Its IUPAC name is N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide
PubChem CID4012245
Molecular FormulaC16H21ClN2O4S
Molecular Weight372.87 g/mol
Exact Mass372.09
IUPAC NameN-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide
SMILESO=C(Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1)C1CCCC1
InChIInChI=1S/C16H21ClN2O4S/c17-14-6-5-13(18-16(20)12-3-1-2-4-12)11-15(14)24(21,22)19-7-9-23-10-8-19/h5-6,11-12H,1-4,7-10H2,(H,18,20)
InChIKeyDRVRPFJXZRHFSN-UHFFFAOYSA-N
XLogP2.49
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.87
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[4-chloro-3-(morpholine-4-sulfonyl)phenyl]acetamide
CID 3816252
2-chloro-N-[4-chloro-3-[2-methoxyethyl(methyl)sulfamoyl]phenyl]acetamide
CID 138857439
N-(3-piperidin-1-ylsulfonylphenyl)cyclopentanecarboxamide
CID 3934723
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-phenylsulfanylacetamide
CID 5021320
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-cyclopentylacetamide
CID 5107523
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)benzamide
CID 3158002
2-(4-chlorophenyl)-N-[4-(morpholin-4-ylsulfonyl)phenyl]acetamide
CID 1164400
N-(4-chlorophenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1548697
[2-(4-Chloro-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate
CID 4004588
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 4424734
N-[3-[(4-chlorophenyl)sulfamoyl]-4-morpholin-4-ylphenyl]propanamide
CID 4424826
[2-[4-Chloro-3-[ethyl(phenyl)sulfamoyl]anilino]-2-oxoethyl] cyclopropanecarboxylate
CID 4645455

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide?
The IUPAC name of N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide (CID 4012245) is N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide is O=C(Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1)C1CCCC1.
What is the InChIKey of N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide?
The InChIKey is DRVRPFJXZRHFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21ClN2O4S/c17-14-6-5-13(18-16(20)12-3-1-2-4-12)11-15(14)24(21,22)19-7-9-23-10-8-19/h5-6,11-12H,1-4,7-10H2,(H,18,20).
What are the key properties of N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide?
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide has a molecular weight of 372.87 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide is sourced from PubChem (CID 4012245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).