1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide

C10H18N2O2 — CID 171749405

IUPAC1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide
SMILESCC(=O)CNC(=O)C1CCN(C)CC1
InChIInChI=1S/C10H18N2O2/c1-8(13)7-11-10(14)9-3-5-12(2)6-4-9/h9H,3-7H2,1-2H3,(H,11,14)
InChIKeyVWQNOEQILFOAIK-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.03
Rot. Bonds3

About 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide

1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide (PubChem CID 171749405) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide
PubChem CID171749405
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide
SMILESCC(=O)CNC(=O)C1CCN(C)CC1
InChIInChI=1S/C10H18N2O2/c1-8(13)7-11-10(14)9-3-5-12(2)6-4-9/h9H,3-7H2,1-2H3,(H,11,14)
InChIKeyVWQNOEQILFOAIK-UHFFFAOYSA-N
XLogP0.03
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide?
The IUPAC name of 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide (CID 171749405) is 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide?
The canonical SMILES for 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide is CC(=O)CNC(=O)C1CCN(C)CC1.
What is the InChIKey of 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide?
The InChIKey is VWQNOEQILFOAIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-8(13)7-11-10(14)9-3-5-12(2)6-4-9/h9H,3-7H2,1-2H3,(H,11,14).
What are the key properties of 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide?
1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide has a molecular weight of 198.27 g/mol, XLogP of 0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-oxopropyl)piperidine-4-carboxamide is sourced from PubChem (CID 171749405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).