2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide

C25H28N2O3 — CID 24565254

IUPAC2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide
SMILESCCOc1ccc(OCC)c(NC(=O)CNC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C25H28N2O3/c1-3-29-21-15-16-23(30-4-2)22(17-21)27-24(28)18-26-25(19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-17,25-26H,3-4,18H2,1-2H3,(H,27,28)
InChIKeyRTHKOBJJIFUYHM-UHFFFAOYSA-N
MW404.51 g/mol
LogP4.80
Rot. Bonds10

About 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide

2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide (PubChem CID 24565254) has the molecular formula C25H28N2O3 and a molecular weight of 404.51 g/mol. Its IUPAC name is 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide
PubChem CID24565254
Molecular FormulaC25H28N2O3
Molecular Weight404.51 g/mol
Exact Mass404.21
IUPAC Name2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide
SMILESCCOc1ccc(OCC)c(NC(=O)CNC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C25H28N2O3/c1-3-29-21-15-16-23(30-4-2)22(17-21)27-24(28)18-26-25(19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-17,25-26H,3-4,18H2,1-2H3,(H,27,28)
InChIKeyRTHKOBJJIFUYHM-UHFFFAOYSA-N
XLogP4.80
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.51
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-diethoxyphenyl)-2-(propan-2-ylamino)acetamide
CID 60703669
4-(2,5-diethoxyanilino)-4-oxobutanoic acid
CID 1133656
N-(2,5-diethoxyphenyl)-4-phenoxybutanamide
CID 31526572
2-(2-chlorophenyl)-N-(2,5-diethoxyphenyl)acetamide
CID 26179955
N-(3,4-diethoxyphenyl)-2-[[(4-fluorophenyl)-phenylmethyl]amino]acetamide
CID 60537379
N-(2,5-diethoxyphenyl)-2-methoxyacetamide
CID 34737899
2-(benzhydrylamino)-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
CID 24565249
N-(2,5-diethoxyphenyl)-3-(2-ethoxyphenyl)propanamide
CID 33002086
N-(2,5-diethoxyphenyl)-2-methylsulfanylacetamide
CID 33312505
N-(2,5-diethoxyphenyl)-2-ethoxybenzamide
CID 43000684
N-(4-ethoxyphenyl)-2-(1-phenylpropylamino)acetamide
CID 54845214
2-(benzhydrylamino)-N-(2-methoxy-5-nitrophenyl)acetamide
CID 9101632

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide?
The IUPAC name of 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide (CID 24565254) is 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide.
What is the SMILES notation for 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide?
The canonical SMILES for 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide is CCOc1ccc(OCC)c(NC(=O)CNC(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide?
The InChIKey is RTHKOBJJIFUYHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O3/c1-3-29-21-15-16-23(30-4-2)22(17-21)27-24(28)18-26-25(19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-17,25-26H,3-4,18H2,1-2H3,(H,27,28).
What are the key properties of 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide?
2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide has a molecular weight of 404.51 g/mol, XLogP of 4.80, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)-N-(2,5-diethoxyphenyl)acetamide is sourced from PubChem (CID 24565254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).