N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide

C25H26N2O2 — CID 55351492

IUPACN-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide
SMILESCC(=O)c1cccc(NC(=O)C(c2ccccc2)N(C)Cc2ccccc2C)c1
InChIInChI=1S/C25H26N2O2/c1-18-10-7-8-13-22(18)17-27(3)24(20-11-5-4-6-12-20)25(29)26-23-15-9-14-21(16-23)19(2)28/h4-16,24H,17H2,1-3H3,(H,26,29)
InChIKeyPLLPEXJUVXZWTL-UHFFFAOYSA-N
MW386.50 g/mol
LogP5.01
Rot. Bonds7

About N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide

N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide (PubChem CID 55351492) has the molecular formula C25H26N2O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide
PubChem CID55351492
Molecular FormulaC25H26N2O2
Molecular Weight386.50 g/mol
Exact Mass386.20
IUPAC NameN-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide
SMILESCC(=O)c1cccc(NC(=O)C(c2ccccc2)N(C)Cc2ccccc2C)c1
InChIInChI=1S/C25H26N2O2/c1-18-10-7-8-13-22(18)17-27(3)24(20-11-5-4-6-12-20)25(29)26-23-15-9-14-21(16-23)19(2)28/h4-16,24H,17H2,1-3H3,(H,26,29)
InChIKeyPLLPEXJUVXZWTL-UHFFFAOYSA-N
XLogP5.01
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.50
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-phenylacetamide
CID 17453268
(2S)-N-(3-acetylphenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide
CID 9045544
2-[acetyl-[(2-methylphenyl)methyl]amino]-N-(3-acetylphenyl)acetamide
CID 113161495
2-[(2-fluorophenyl)methyl-methylamino]-N,2-diphenylacetamide
CID 18124307
(2S)-2-[methyl-[(2-methylphenyl)methyl]amino]-N-phenylpropanamide
CID 8516653
(2S)-N-(2-methoxy-5-methylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide
CID 8516586
(2S)-N-(3-acetylphenyl)-2-[(4,5-dimethoxy-2-methylphenyl)methyl-methylamino]propanamide
CID 8550993
N-(3-acetylphenyl)-2-phenylpentanamide
CID 43009729
2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide
CID 55471442
(2S)-N-(3-acetylphenyl)-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]propanamide
CID 8805401
(2S)-N-(3-acetylphenyl)-2-[[(1S)-1-phenylethyl]amino]propanamide
CID 8898640
N-[3-[[methyl-[(2-methylphenyl)methyl]carbamoyl]amino]phenyl]acetamide
CID 86987874

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide?
The IUPAC name of N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide (CID 55351492) is N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide is CC(=O)c1cccc(NC(=O)C(c2ccccc2)N(C)Cc2ccccc2C)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide?
The InChIKey is PLLPEXJUVXZWTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O2/c1-18-10-7-8-13-22(18)17-27(3)24(20-11-5-4-6-12-20)25(29)26-23-15-9-14-21(16-23)19(2)28/h4-16,24H,17H2,1-3H3,(H,26,29).
What are the key properties of N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide?
N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide has a molecular weight of 386.50 g/mol, XLogP of 5.01, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide is sourced from PubChem (CID 55351492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).