1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide

C17H24N2O2 — CID 60681090

IUPAC1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide
SMILESCc1cc(C)c(C(=O)CN2CCCCC2C(N)=O)cc1C
InChIInChI=1S/C17H24N2O2/c1-11-8-13(3)14(9-12(11)2)16(20)10-19-7-5-4-6-15(19)17(18)21/h8-9,15H,4-7,10H2,1-3H3,(H2,18,21)
InChIKeyZZAAPDWWDVTYGR-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.13
Rot. Bonds4

About 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide

1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide (PubChem CID 60681090) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide
PubChem CID60681090
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide
SMILESCc1cc(C)c(C(=O)CN2CCCCC2C(N)=O)cc1C
InChIInChI=1S/C17H24N2O2/c1-11-8-13(3)14(9-12(11)2)16(20)10-19-7-5-4-6-15(19)17(18)21/h8-9,15H,4-7,10H2,1-3H3,(H2,18,21)
InChIKeyZZAAPDWWDVTYGR-UHFFFAOYSA-N
XLogP2.13
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]piperidine-2-carboxamide
CID 60677071
1-[2-(4-methylphenyl)-2-oxoethyl]piperidine-2-carboxamide
CID 60680985
1-[2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 60680059
1-[2-(4-methylsulfanylphenyl)-2-oxoethyl]piperidine-2-carboxamide
CID 60680989
(2S)-1-[2-(3,4-dimethylanilino)-2-oxoethyl]piperidine-2-carboxamide
CID 41096237
1-phenacylpiperidine-2-carboxamide
CID 60681003
(2R)-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]piperidine-2-carboxamide
CID 41292691
1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide
CID 62037237
(2S)-1-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidine-2-carboxamide
CID 40987983
1-(3-methoxy-2-oxopropyl)piperidine-2-carboxamide
CID 107507306
1-(2-oxo-2-thiophen-2-ylethyl)piperidine-2-carboxamide
CID 60680965
[2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 1-(cyclopentanecarbonyl)piperidine-2-carboxylate
CID 71874667

Frequently Asked Questions

What is the IUPAC name of 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide?
The IUPAC name of 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide (CID 60681090) is 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide.
What is the SMILES notation for 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide?
The canonical SMILES for 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide is Cc1cc(C)c(C(=O)CN2CCCCC2C(N)=O)cc1C.
What is the InChIKey of 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide?
The InChIKey is ZZAAPDWWDVTYGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-11-8-13(3)14(9-12(11)2)16(20)10-19-7-5-4-6-15(19)17(18)21/h8-9,15H,4-7,10H2,1-3H3,(H2,18,21).
What are the key properties of 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide?
1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 60681090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).