N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide

C19H26N2O3 — CID 171143816

IUPACN-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
SMILESCOCCN1C(=O)CCC(C(=O)NC2CC2)C1c1ccc(C)cc1
InChIInChI=1S/C19H26N2O3/c1-13-3-5-14(6-4-13)18-16(19(23)20-15-7-8-15)9-10-17(22)21(18)11-12-24-2/h3-6,15-16,18H,7-12H2,1-2H3,(H,20,23)
InChIKeyNOCQAVPJRNRCAY-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.20
Rot. Bonds6

About N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide

N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide (PubChem CID 171143816) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
PubChem CID171143816
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC NameN-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
SMILESCOCCN1C(=O)CCC(C(=O)NC2CC2)C1c1ccc(C)cc1
InChIInChI=1S/C19H26N2O3/c1-13-3-5-14(6-4-13)18-16(19(23)20-15-7-8-15)9-10-17(22)21(18)11-12-24-2/h3-6,15-16,18H,7-12H2,1-2H3,(H,20,23)
InChIKeyNOCQAVPJRNRCAY-UHFFFAOYSA-N
XLogP2.20
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide (CID 171143816) is N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide is COCCN1C(=O)CCC(C(=O)NC2CC2)C1c1ccc(C)cc1.
What is the InChIKey of N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide?
The InChIKey is NOCQAVPJRNRCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-13-3-5-14(6-4-13)18-16(19(23)20-15-7-8-15)9-10-17(22)21(18)11-12-24-2/h3-6,15-16,18H,7-12H2,1-2H3,(H,20,23).
What are the key properties of N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide?
N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 171143816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).