1-(5-hydroxy-4-methylpentyl)piperidin-2-one

C11H21NO2 — CID 106159311

IUPAC1-(5-hydroxy-4-methylpentyl)piperidin-2-one
SMILESCC(CO)CCCN1CCCCC1=O
InChIInChI=1S/C11H21NO2/c1-10(9-13)5-4-8-12-7-3-2-6-11(12)14/h10,13H,2-9H2,1H3
InChIKeyCBZRGDHGMJKRES-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.41
Rot. Bonds5

About 1-(5-hydroxy-4-methylpentyl)piperidin-2-one

1-(5-hydroxy-4-methylpentyl)piperidin-2-one (PubChem CID 106159311) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-(5-hydroxy-4-methylpentyl)piperidin-2-one.

Molecular Properties

Compound Name1-(5-hydroxy-4-methylpentyl)piperidin-2-one
PubChem CID106159311
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-(5-hydroxy-4-methylpentyl)piperidin-2-one
SMILESCC(CO)CCCN1CCCCC1=O
InChIInChI=1S/C11H21NO2/c1-10(9-13)5-4-8-12-7-3-2-6-11(12)14/h10,13H,2-9H2,1H3
InChIKeyCBZRGDHGMJKRES-UHFFFAOYSA-N
XLogP1.41
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-hydroxy-4-methylpentyl)pyrrolidin-2-one
CID 106159349
1-(4-hydroxybutyl)azepan-2-one
CID 43509760
1-[3-(propan-2-ylamino)propyl]azepan-2-one
CID 60695423
2-methyl-4-(2-oxopiperidin-1-yl)butanoic acid
CID 12842030
4-(2-oxopiperidin-1-yl)butanoic acid
CID 12842029
5-(2-oxopiperidin-1-yl)pentanenitrile
CID 11412726
N-(1-hydroxy-3-methoxypropan-2-yl)-4-(2-oxopiperidin-1-yl)butanamide
CID 122561315
1-(4-sulfanylhexyl)pyrrolidin-2-one
CID 141416613
1-[(3S)-3-(2-oxoazepan-1-yl)butyl]azepan-2-one
CID 139182076
1-(22-hydroxydocosyl)pyrrolidin-2-one
CID 151557638
1-(3-chloropropyl)azepan-2-one
CID 14811847
4-(2-oxoazepan-1-yl)butanamide
CID 90945049

Frequently Asked Questions

What is the IUPAC name of 1-(5-hydroxy-4-methylpentyl)piperidin-2-one?
The IUPAC name of 1-(5-hydroxy-4-methylpentyl)piperidin-2-one (CID 106159311) is 1-(5-hydroxy-4-methylpentyl)piperidin-2-one.
What is the SMILES notation for 1-(5-hydroxy-4-methylpentyl)piperidin-2-one?
The canonical SMILES for 1-(5-hydroxy-4-methylpentyl)piperidin-2-one is CC(CO)CCCN1CCCCC1=O.
What is the InChIKey of 1-(5-hydroxy-4-methylpentyl)piperidin-2-one?
The InChIKey is CBZRGDHGMJKRES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-10(9-13)5-4-8-12-7-3-2-6-11(12)14/h10,13H,2-9H2,1H3.
What are the key properties of 1-(5-hydroxy-4-methylpentyl)piperidin-2-one?
1-(5-hydroxy-4-methylpentyl)piperidin-2-one has a molecular weight of 199.29 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-hydroxy-4-methylpentyl)piperidin-2-one is sourced from PubChem (CID 106159311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).