5-(5-hydroxypentylamino)-1-methylpiperidin-2-one

C11H22N2O2 — CID 64656153

IUPAC5-(5-hydroxypentylamino)-1-methylpiperidin-2-one
SMILESCN1CC(NCCCCCO)CCC1=O
InChIInChI=1S/C11H22N2O2/c1-13-9-10(5-6-11(13)15)12-7-3-2-4-8-14/h10,12,14H,2-9H2,1H3
InChIKeyKBEPNUZBJLURLB-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.36
Rot. Bonds6

About 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one

5-(5-hydroxypentylamino)-1-methylpiperidin-2-one (PubChem CID 64656153) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one.

Molecular Properties

Compound Name5-(5-hydroxypentylamino)-1-methylpiperidin-2-one
PubChem CID64656153
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name5-(5-hydroxypentylamino)-1-methylpiperidin-2-one
SMILESCN1CC(NCCCCCO)CCC1=O
InChIInChI=1S/C11H22N2O2/c1-13-9-10(5-6-11(13)15)12-7-3-2-4-8-14/h10,12,14H,2-9H2,1H3
InChIKeyKBEPNUZBJLURLB-UHFFFAOYSA-N
XLogP0.36
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one?
The IUPAC name of 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one (CID 64656153) is 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one.
What is the SMILES notation for 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one?
The canonical SMILES for 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one is CN1CC(NCCCCCO)CCC1=O.
What is the InChIKey of 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one?
The InChIKey is KBEPNUZBJLURLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-13-9-10(5-6-11(13)15)12-7-3-2-4-8-14/h10,12,14H,2-9H2,1H3.
What are the key properties of 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one?
5-(5-hydroxypentylamino)-1-methylpiperidin-2-one has a molecular weight of 214.31 g/mol, XLogP of 0.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-hydroxypentylamino)-1-methylpiperidin-2-one is sourced from PubChem (CID 64656153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).