1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide

C23H28N2O2 — CID 11810626

IUPAC1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide
SMILESCc1ccc(C(=O)CN2CCC(C(=O)NCCc3ccccc3)CC2)cc1
InChIInChI=1S/C23H28N2O2/c1-18-7-9-20(10-8-18)22(26)17-25-15-12-21(13-16-25)23(27)24-14-11-19-5-3-2-4-6-19/h2-10,21H,11-17H2,1H3,(H,24,27)
InChIKeyHHFCBONKPFYCGN-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.25
Rot. Bonds7

About 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide

1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide (PubChem CID 11810626) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide
PubChem CID11810626
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC Name1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide
SMILESCc1ccc(C(=O)CN2CCC(C(=O)NCCc3ccccc3)CC2)cc1
InChIInChI=1S/C23H28N2O2/c1-18-7-9-20(10-8-18)22(26)17-25-15-12-21(13-16-25)23(27)24-14-11-19-5-3-2-4-6-19/h2-10,21H,11-17H2,1H3,(H,24,27)
InChIKeyHHFCBONKPFYCGN-UHFFFAOYSA-N
XLogP3.25
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2,4-dimethylanilino)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide
CID 16910175
N-(3-methoxypropyl)-1-[2-oxo-2-(2-phenylethylamino)ethyl]piperidine-4-carboxamide
CID 55909398
N-[2-(4-methoxyphenyl)ethyl]-1-[2-(4-methylanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 16809626
1-[2-(3,4-dichloroanilino)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide
CID 16909938
1-(3,3-diphenylpropyl)-N-(2-phenylethyl)piperidine-4-carboxamide
CID 25223132
ethane;1-(4-methylphenyl)-2-pyrrolidin-1-ylethanone
CID 156853457
1-(4-bromobenzoyl)-N-(2-phenylethyl)piperidine-4-carboxamide
CID 27670954
1-benzyl-N-(3-phenylpropyl)piperidine-4-carboxamide
CID 46773938
1-(4-methylphenyl)sulfonyl-N-(3-phenylpropyl)piperidine-4-carboxamide
CID 8795286
1-[(3-methoxyphenyl)methyl]-N-(2-phenylethyl)piperidine-4-carboxamide
CID 1343442
1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2-phenylethyl)piperidine-4-carboxamide
CID 38139524
1-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]-N-propylpiperidine-4-carboxamide
CID 134046327

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide?
The IUPAC name of 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide (CID 11810626) is 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide is Cc1ccc(C(=O)CN2CCC(C(=O)NCCc3ccccc3)CC2)cc1.
What is the InChIKey of 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide?
The InChIKey is HHFCBONKPFYCGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2/c1-18-7-9-20(10-8-18)22(26)17-25-15-12-21(13-16-25)23(27)24-14-11-19-5-3-2-4-6-19/h2-10,21H,11-17H2,1H3,(H,24,27).
What are the key properties of 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide?
1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide has a molecular weight of 364.49 g/mol, XLogP of 3.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methylphenyl)-2-oxoethyl]-N-(2-phenylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 11810626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).