2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one

C15H29N3O4S — CID 110625583

IUPAC2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one
SMILESCC(C)CC(NS(=O)(=O)NC1CCCC1)C(=O)N1CCOCC1
InChIInChI=1S/C15H29N3O4S/c1-12(2)11-14(15(19)18-7-9-22-10-8-18)17-23(20,21)16-13-5-3-4-6-13/h12-14,16-17H,3-11H2,1-2H3
InChIKeyWENINIKVFKWCTJ-UHFFFAOYSA-N
MW347.48 g/mol
LogP0.63
Rot. Bonds7

About 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one

2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one (PubChem CID 110625583) has the molecular formula C15H29N3O4S and a molecular weight of 347.48 g/mol. Its IUPAC name is 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one.

Molecular Properties

Compound Name2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one
PubChem CID110625583
Molecular FormulaC15H29N3O4S
Molecular Weight347.48 g/mol
Exact Mass347.19
IUPAC Name2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one
SMILESCC(C)CC(NS(=O)(=O)NC1CCCC1)C(=O)N1CCOCC1
InChIInChI=1S/C15H29N3O4S/c1-12(2)11-14(15(19)18-7-9-22-10-8-18)17-23(20,21)16-13-5-3-4-6-13/h12-14,16-17H,3-11H2,1-2H3
InChIKeyWENINIKVFKWCTJ-UHFFFAOYSA-N
XLogP0.63
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.48
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-cyclohexyl-4-methyl-1-morpholin-4-ylpentan-1-one
CID 159145676
[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]carbamic acid
CID 175945134
2-(2-methoxyethoxy)-N-(4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl)ethanesulfonamide
CID 110625586
2-(cyclopentylamino)-1-morpholin-4-ylpropan-1-one
CID 43083614
4-methyl-N-[(2R)-4-methyl-1-[16-[(2R)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]-1-oxopentan-2-yl]benzenesulfonamide
CID 124600524
(2S)-2-(cyclohexylamino)-1-morpholin-4-ylpropan-1-one
CID 51675158
N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]-1-(4-methylphenyl)methanesulfonamide
CID 110285627
N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide
CID 110285618
N-[4-[[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]sulfamoyl]phenyl]acetamide
CID 110285631
3,5-dimethyl-N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]-1H-pyrazole-4-sulfonamide
CID 110285637
N-[(2S)-4-methyl-1-(4-methylpiperazin-1-yl)-1-oxopentan-2-yl]morpholine-4-carboxamide
CID 110285714
N-[(3R)-1-[(2R)-2-(methanesulfonamido)-4-methylpentanoyl]piperidin-3-yl]acetamide
CID 97313843

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one?
The IUPAC name of 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one (CID 110625583) is 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one.
What is the SMILES notation for 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one?
The canonical SMILES for 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one is CC(C)CC(NS(=O)(=O)NC1CCCC1)C(=O)N1CCOCC1.
What is the InChIKey of 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one?
The InChIKey is WENINIKVFKWCTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O4S/c1-12(2)11-14(15(19)18-7-9-22-10-8-18)17-23(20,21)16-13-5-3-4-6-13/h12-14,16-17H,3-11H2,1-2H3.
What are the key properties of 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one?
2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one has a molecular weight of 347.48 g/mol, XLogP of 0.63, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylsulfamoylamino)-4-methyl-1-morpholin-4-ylpentan-1-one is sourced from PubChem (CID 110625583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).