5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide

C27H32N2O2 — CID 19088507

IUPAC5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide
SMILESCOc1ccc(CCN(C)CCCC(C(N)=O)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C27H32N2O2/c1-29(21-18-22-14-16-25(31-2)17-15-22)20-9-19-27(26(28)30,23-10-5-3-6-11-23)24-12-7-4-8-13-24/h3-8,10-17H,9,18-21H2,1-2H3,(H2,28,30)
InChIKeyFVKPBVWPTAATEI-UHFFFAOYSA-N
MW416.57 g/mol
LogP4.42
Rot. Bonds11

About 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide

5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide (PubChem CID 19088507) has the molecular formula C27H32N2O2 and a molecular weight of 416.57 g/mol. Its IUPAC name is 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide.

Molecular Properties

Compound Name5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide
PubChem CID19088507
Molecular FormulaC27H32N2O2
Molecular Weight416.57 g/mol
Exact Mass416.25
IUPAC Name5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide
SMILESCOc1ccc(CCN(C)CCCC(C(N)=O)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C27H32N2O2/c1-29(21-18-22-14-16-25(31-2)17-15-22)20-9-19-27(26(28)30,23-10-5-3-6-11-23)24-12-7-4-8-13-24/h3-8,10-17H,9,18-21H2,1-2H3,(H2,28,30)
InChIKeyFVKPBVWPTAATEI-UHFFFAOYSA-N
XLogP4.42
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.57
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[(5-amino-5-oxo-4,4-diphenylpentyl)-methylamino]ethyl]-4-(sulfinatoamino)benzene
CID 19088481
4-[methyl(3-phenylpropyl)amino]-2,2-diphenylbutanamide
CID 19088491
3-[3-(4-methoxyphenyl)propyl-methylamino]propanoic acid
CID 19776427
methyl 2-amino-2-methyl-5-[methyl(2-phenylethyl)amino]pentanoate
CID 65487858
1-[2-(4-methoxyphenyl)ethyl]-1-methylurea
CID 115168599
2-amino-2-methyl-5-[methyl(2-phenylethyl)amino]pentanoic acid
CID 65487093
2,2-diphenylhexanamide;hydrochloride
CID 142429226
2-(4-chlorophenyl)-2-cyclopropyl-5-[2-(4-methoxyphenyl)ethyl-methylamino]pentanenitrile
CID 23582438
2-[2-(4-methoxyphenyl)ethyl-methylamino]propanoic acid
CID 62638720
2-[2-(4-methoxyphenyl)ethyl]-2-(2-phenylethyl)propanedioic acid
CID 122530743
2-[(6-amino-6-oxo-5,5-diphenylhexyl)-(carboxymethyl)amino]acetic acid
CID 20556762
(4-methoxyphenyl)methyl 2-hydroxy-2,2-diphenylacetate
CID 16577341

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide?
The IUPAC name of 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide (CID 19088507) is 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide.
What is the SMILES notation for 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide?
The canonical SMILES for 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide is COc1ccc(CCN(C)CCCC(C(N)=O)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide?
The InChIKey is FVKPBVWPTAATEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32N2O2/c1-29(21-18-22-14-16-25(31-2)17-15-22)20-9-19-27(26(28)30,23-10-5-3-6-11-23)24-12-7-4-8-13-24/h3-8,10-17H,9,18-21H2,1-2H3,(H2,28,30).
What are the key properties of 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide?
5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide has a molecular weight of 416.57 g/mol, XLogP of 4.42, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-methoxyphenyl)ethyl-methylamino]-2,2-diphenylpentanamide is sourced from PubChem (CID 19088507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).