1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide

C11H20N2O3 — CID 79201154

IUPAC1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1C(=O)CCCO
InChIInChI=1S/C11H20N2O3/c1-8-4-5-9(11(12)16)7-13(8)10(15)3-2-6-14/h8-9,14H,2-7H2,1H3,(H2,12,16)
InChIKeyQRJBOJHNTRBNFX-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.13
Rot. Bonds4

About 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide

1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide (PubChem CID 79201154) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide
PubChem CID79201154
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1C(=O)CCCO
InChIInChI=1S/C11H20N2O3/c1-8-4-5-9(11(12)16)7-13(8)10(15)3-2-6-14/h8-9,14H,2-7H2,1H3,(H2,12,16)
InChIKeyQRJBOJHNTRBNFX-UHFFFAOYSA-N
XLogP-0.13
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide (CID 79201154) is 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide is CC1CCC(C(N)=O)CN1C(=O)CCCO.
What is the InChIKey of 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide?
The InChIKey is QRJBOJHNTRBNFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-8-4-5-9(11(12)16)7-13(8)10(15)3-2-6-14/h8-9,14H,2-7H2,1H3,(H2,12,16).
What are the key properties of 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide?
1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide has a molecular weight of 228.29 g/mol, XLogP of -0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 79201154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).