2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide

C24H31N3O3 — CID 112796758

IUPAC2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide
SMILESCCN(CC(=O)Nc1cccc(OC)c1)C(C(=O)N1CCCCC1)c1ccccc1
InChIInChI=1S/C24H31N3O3/c1-3-26(18-22(28)25-20-13-10-14-21(17-20)30-2)23(19-11-6-4-7-12-19)24(29)27-15-8-5-9-16-27/h4,6-7,10-14,17,23H,3,5,8-9,15-16,18H2,1-2H3,(H,25,28)
InChIKeyIAQOEXFQZWCQFV-UHFFFAOYSA-N
MW409.53 g/mol
LogP3.71
Rot. Bonds8

About 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide

2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide (PubChem CID 112796758) has the molecular formula C24H31N3O3 and a molecular weight of 409.53 g/mol. Its IUPAC name is 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide
PubChem CID112796758
Molecular FormulaC24H31N3O3
Molecular Weight409.53 g/mol
Exact Mass409.24
IUPAC Name2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide
SMILESCCN(CC(=O)Nc1cccc(OC)c1)C(C(=O)N1CCCCC1)c1ccccc1
InChIInChI=1S/C24H31N3O3/c1-3-26(18-22(28)25-20-13-10-14-21(17-20)30-2)23(19-11-6-4-7-12-19)24(29)27-15-8-5-9-16-27/h4,6-7,10-14,17,23H,3,5,8-9,15-16,18H2,1-2H3,(H,25,28)
InChIKeyIAQOEXFQZWCQFV-UHFFFAOYSA-N
XLogP3.71
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.53
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetamidophenyl)-2-[ethyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]acetamide
CID 8791437
N-(3-methoxyphenyl)-2-[methyl-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]acetamide
CID 4880688
3-[ethyl-[2-(3-methoxyanilino)-2-oxoethyl]amino]-2-methylpropanoic acid
CID 62851901
methyl 2-[ethyl-[2-(3-methoxyanilino)-2-oxoethyl]amino]acetate
CID 60674332
2-(N-ethylanilino)-N-(3-methoxyphenyl)acetamide
CID 51159812
2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide
CID 8583685
N-[2-(3-methoxyanilino)-2-oxoethyl]-N-methyl-3,3-diphenylpropanamide
CID 2594494
2-[[2-(1,2-diphenylethylamino)-2-oxoethyl]-ethylamino]-N-(3-methoxyphenyl)acetamide
CID 46594882
N-(3-methoxyphenyl)-2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide
CID 4883661
2-(3-methoxyanilino)-1-piperidin-1-ylpropan-1-one
CID 43083385
2-(diethylamino)-1-[4-(2-methoxybenzoyl)-1,4-diazepan-1-yl]-2-phenylethanone
CID 56552747
2-(diethylamino)-1-[4-(4-methoxybenzoyl)piperidin-1-yl]-2-phenylethanone
CID 56540565

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide (CID 112796758) is 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide is CCN(CC(=O)Nc1cccc(OC)c1)C(C(=O)N1CCCCC1)c1ccccc1.
What is the InChIKey of 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide?
The InChIKey is IAQOEXFQZWCQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N3O3/c1-3-26(18-22(28)25-20-13-10-14-21(17-20)30-2)23(19-11-6-4-7-12-19)24(29)27-15-8-5-9-16-27/h4,6-7,10-14,17,23H,3,5,8-9,15-16,18H2,1-2H3,(H,25,28).
What are the key properties of 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide?
2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide has a molecular weight of 409.53 g/mol, XLogP of 3.71, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)amino]-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 112796758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).