N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide

C14H25N3O2 — CID 78968206

IUPACN-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide
SMILESCCN1CCC(N(C)C(=O)C2CCC(=O)NC2)CC1
InChIInChI=1S/C14H25N3O2/c1-3-17-8-6-12(7-9-17)16(2)14(19)11-4-5-13(18)15-10-11/h11-12H,3-10H2,1-2H3,(H,15,18)
InChIKeyHHKFKNCNJJRXIP-UHFFFAOYSA-N
MW267.37 g/mol
LogP0.46
Rot. Bonds3

About N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide

N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide (PubChem CID 78968206) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide
PubChem CID78968206
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC NameN-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide
SMILESCCN1CCC(N(C)C(=O)C2CCC(=O)NC2)CC1
InChIInChI=1S/C14H25N3O2/c1-3-17-8-6-12(7-9-17)16(2)14(19)11-4-5-13(18)15-10-11/h11-12H,3-10H2,1-2H3,(H,15,18)
InChIKeyHHKFKNCNJJRXIP-UHFFFAOYSA-N
XLogP0.46
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide (CID 78968206) is N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide is CCN1CCC(N(C)C(=O)C2CCC(=O)NC2)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide?
The InChIKey is HHKFKNCNJJRXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-3-17-8-6-12(7-9-17)16(2)14(19)11-4-5-13(18)15-10-11/h11-12H,3-10H2,1-2H3,(H,15,18).
What are the key properties of N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide?
N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide has a molecular weight of 267.37 g/mol, XLogP of 0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 78968206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).