2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide

C26H29N3O3 — CID 112769408

IUPAC2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide
SMILESCCN(CC(=O)Nc1ccccc1OC)C(C)C(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C26H29N3O3/c1-4-29(18-25(30)27-23-16-10-11-17-24(23)32-3)19(2)26(31)28-22-15-9-8-14-21(22)20-12-6-5-7-13-20/h5-17,19H,4,18H2,1-3H3,(H,27,30)(H,28,31)
InChIKeyDNCDESKBGFNLQR-UHFFFAOYSA-N
MW431.54 g/mol
LogP4.65
Rot. Bonds9

About 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide

2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide (PubChem CID 112769408) has the molecular formula C26H29N3O3 and a molecular weight of 431.54 g/mol. Its IUPAC name is 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide.

Molecular Properties

Compound Name2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide
PubChem CID112769408
Molecular FormulaC26H29N3O3
Molecular Weight431.54 g/mol
Exact Mass431.22
IUPAC Name2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide
SMILESCCN(CC(=O)Nc1ccccc1OC)C(C)C(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C26H29N3O3/c1-4-29(18-25(30)27-23-16-10-11-17-24(23)32-3)19(2)26(31)28-22-15-9-8-14-21(22)20-12-6-5-7-13-20/h5-17,19H,4,18H2,1-3H3,(H,27,30)(H,28,31)
InChIKeyDNCDESKBGFNLQR-UHFFFAOYSA-N
XLogP4.65
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.54
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)acetamide
CID 4882753
N-(2,5-dichlorophenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]propanamide
CID 112769409
3-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]butanoic acid
CID 62827296
N-(3-bromophenyl)-2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]propanamide
CID 112798835
ethyl-[2-(2-methoxyanilino)-2-oxoethyl]-[2-oxo-2-(2-phenylanilino)ethyl]azanium
CID 7594329
2-(2-methoxyanilino)-N-(2-phenylphenyl)acetamide
CID 9080600
(2R)-2-[[2-(2-methoxyanilino)-2-oxoethyl]-propylamino]-N-[(2R)-4-phenylbutan-2-yl]propanamide
CID 98306609
2-(N-ethylanilino)-N-(2-methoxyphenyl)acetamide
CID 17052689
2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-N-(2-methoxyphenyl)propanamide
CID 46561666
(2R)-N-(2-methoxyphenyl)-2-[methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]amino]propanamide
CID 7986544
N-(2-methoxyphenyl)-2-[methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]propanamide
CID 17437130
(2S)-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-phenylphenyl)propanamide
CID 9049661

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide?
The IUPAC name of 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide (CID 112769408) is 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide.
What is the SMILES notation for 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide?
The canonical SMILES for 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide is CCN(CC(=O)Nc1ccccc1OC)C(C)C(=O)Nc1ccccc1-c1ccccc1.
What is the InChIKey of 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide?
The InChIKey is DNCDESKBGFNLQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N3O3/c1-4-29(18-25(30)27-23-16-10-11-17-24(23)32-3)19(2)26(31)28-22-15-9-8-14-21(22)20-12-6-5-7-13-20/h5-17,19H,4,18H2,1-3H3,(H,27,30)(H,28,31).
What are the key properties of 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide?
2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide has a molecular weight of 431.54 g/mol, XLogP of 4.65, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]-N-(2-phenylphenyl)propanamide is sourced from PubChem (CID 112769408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).