N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide

C18H26N2O4S — CID 17453405

IUPACN-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
SMILESO=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NC1CCCC1
InChIInChI=1S/C18H26N2O4S/c21-18(19-16-3-1-2-4-16)10-7-15-5-8-17(9-6-15)25(22,23)20-11-13-24-14-12-20/h5-6,8-9,16H,1-4,7,10-14H2,(H,19,21)
InChIKeyHIBIFZQPIYNOPX-UHFFFAOYSA-N
MW366.48 g/mol
LogP1.70
Rot. Bonds6

About N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide

N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide (PubChem CID 17453405) has the molecular formula C18H26N2O4S and a molecular weight of 366.48 g/mol. Its IUPAC name is N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
PubChem CID17453405
Molecular FormulaC18H26N2O4S
Molecular Weight366.48 g/mol
Exact Mass366.16
IUPAC NameN-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
SMILESO=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NC1CCCC1
InChIInChI=1S/C18H26N2O4S/c21-18(19-16-3-1-2-4-16)10-7-15-5-8-17(9-6-15)25(22,23)20-11-13-24-14-12-20/h5-6,8-9,16H,1-4,7,10-14H2,(H,19,21)
InChIKeyHIBIFZQPIYNOPX-UHFFFAOYSA-N
XLogP1.70
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.48
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The IUPAC name of N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide (CID 17453405) is N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide.
What is the SMILES notation for N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The canonical SMILES for N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide is O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The InChIKey is HIBIFZQPIYNOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O4S/c21-18(19-16-3-1-2-4-16)10-7-15-5-8-17(9-6-15)25(22,23)20-11-13-24-14-12-20/h5-6,8-9,16H,1-4,7,10-14H2,(H,19,21).
What are the key properties of N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide?
N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide has a molecular weight of 366.48 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(4-morpholin-4-ylsulfonylphenyl)propanamide is sourced from PubChem (CID 17453405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).