1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide

C15H21N3O2 — CID 78817800

IUPAC1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
SMILESCNC(=O)CN1CCC(C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C15H21N3O2/c1-16-14(19)11-18-9-7-12(8-10-18)15(20)17-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H,16,19)(H,17,20)
InChIKeyHKXFUKPSQYUECK-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.08
Rot. Bonds4

About 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide

1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide (PubChem CID 78817800) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
PubChem CID78817800
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
SMILESCNC(=O)CN1CCC(C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C15H21N3O2/c1-16-14(19)11-18-9-7-12(8-10-18)15(20)17-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H,16,19)(H,17,20)
InChIKeyHKXFUKPSQYUECK-UHFFFAOYSA-N
XLogP1.08
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[methyl-[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134646
1-(2-amino-2-oxoethyl)-N-phenylpiperidine-4-carboxamide
CID 9134210
1-[2-(4-fluoroanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134233
1-[2-oxo-2-(1-phenylethylamino)ethyl]-N-phenylpiperidine-4-carboxamide
CID 18089114
1-[2-(cyclohexylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134327
1-[2-oxo-2-(2-propan-2-ylanilino)ethyl]-N-phenylpiperidine-4-carboxamide
CID 9134290
1-[2-(3-fluoroanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134379
1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134253
1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134267
1-[2-(2,5-dichloroanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 17486082
1-[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134533
2-(4-hydroxypiperidin-1-yl)-N-phenylacetamide
CID 39902294

Frequently Asked Questions

What is the IUPAC name of 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide?
The IUPAC name of 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide (CID 78817800) is 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide?
The canonical SMILES for 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide is CNC(=O)CN1CCC(C(=O)Nc2ccccc2)CC1.
What is the InChIKey of 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide?
The InChIKey is HKXFUKPSQYUECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-16-14(19)11-18-9-7-12(8-10-18)15(20)17-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H,16,19)(H,17,20).
What are the key properties of 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide?
1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(methylamino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide is sourced from PubChem (CID 78817800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).