[3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone

C17H25N3O4S — CID 110614470

IUPAC[3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone
SMILESCC1COCCN1C(=O)c1cccc(NS(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C17H25N3O4S/c1-13-12-24-10-9-20(13)17(21)14-5-4-8-16(11-14)19-25(22,23)18-15-6-2-3-7-15/h4-5,8,11,13,15,18-19H,2-3,6-7,9-10,12H2,1H3
InChIKeyGFHAIQWQAJRBHW-UHFFFAOYSA-N
MW367.47 g/mol
LogP1.74
Rot. Bonds5

About [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone

[3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone (PubChem CID 110614470) has the molecular formula C17H25N3O4S and a molecular weight of 367.47 g/mol. Its IUPAC name is [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name[3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone
PubChem CID110614470
Molecular FormulaC17H25N3O4S
Molecular Weight367.47 g/mol
Exact Mass367.16
IUPAC Name[3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone
SMILESCC1COCCN1C(=O)c1cccc(NS(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C17H25N3O4S/c1-13-12-24-10-9-20(13)17(21)14-5-4-8-16(11-14)19-25(22,23)18-15-6-2-3-7-15/h4-5,8,11,13,15,18-19H,2-3,6-7,9-10,12H2,1H3
InChIKeyGFHAIQWQAJRBHW-UHFFFAOYSA-N
XLogP1.74
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.47
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methylmorpholin-4-yl)-[3-(propan-2-ylsulfamoylamino)phenyl]methanone
CID 110614469
N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-2-phenylethanesulfonamide
CID 110352919
N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide
CID 110352918
N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-5-oxopyrrolidine-2-carboxamide
CID 110671836
1-(3-chlorophenyl)-3-[3-(3-methylmorpholine-4-carbonyl)phenyl]urea
CID 110352872
2-ethyl-N-[3-(3-methylmorpholine-4-carbonyl)phenyl]butanamide
CID 110352840
N,N-dimethyl-3-(3-methylmorpholine-4-carbonyl)benzenesulfonamide
CID 110354676
(3-methylmorpholin-4-yl)-(3-phenylphenyl)methanone
CID 110292242
N-[4-(3-methylmorpholine-4-carbonyl)phenyl]methanesulfonamide
CID 47174328
2-(4-chlorophenyl)-N-[3-(3-methylmorpholine-4-carbonyl)phenyl]acetamide
CID 110352861
N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-2-(3-methylphenyl)acetamide
CID 110671847
2,3,4-trifluoro-N-[3-(3-methylmorpholine-4-carbonyl)phenyl]benzamide
CID 110352884

Frequently Asked Questions

What is the IUPAC name of [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone?
The IUPAC name of [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone (CID 110614470) is [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone.
What is the SMILES notation for [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone?
The canonical SMILES for [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone is CC1COCCN1C(=O)c1cccc(NS(=O)(=O)NC2CCCC2)c1.
What is the InChIKey of [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone?
The InChIKey is GFHAIQWQAJRBHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O4S/c1-13-12-24-10-9-20(13)17(21)14-5-4-8-16(11-14)19-25(22,23)18-15-6-2-3-7-15/h4-5,8,11,13,15,18-19H,2-3,6-7,9-10,12H2,1H3.
What are the key properties of [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone?
[3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone has a molecular weight of 367.47 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 110614470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).