1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide

C13H24N2O3 — CID 79200487

IUPAC1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide
SMILESCC(O)CCC(=O)N1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C13H24N2O3/c1-10(16)4-5-12(17)15-8-6-11(7-9-15)13(18)14(2)3/h10-11,16H,4-9H2,1-3H3
InChIKeyNEROZHNFDSDWMO-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.47
Rot. Bonds4

About 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide

1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 79200487) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide
PubChem CID79200487
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide
SMILESCC(O)CCC(=O)N1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C13H24N2O3/c1-10(16)4-5-12(17)15-8-6-11(7-9-15)13(18)14(2)3/h10-11,16H,4-9H2,1-3H3
InChIKeyNEROZHNFDSDWMO-UHFFFAOYSA-N
XLogP0.47
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide (CID 79200487) is 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide is CC(O)CCC(=O)N1CCC(C(=O)N(C)C)CC1.
What is the InChIKey of 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is NEROZHNFDSDWMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-10(16)4-5-12(17)15-8-6-11(7-9-15)13(18)14(2)3/h10-11,16H,4-9H2,1-3H3.
What are the key properties of 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide?
1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 0.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxypentanoyl)-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 79200487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).