2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide

C19H24N2O3 — CID 51226942

IUPAC2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide
SMILESCOc1ccc(OC)c(C(C)NC(C)C(=O)Nc2ccccc2)c1
InChIInChI=1S/C19H24N2O3/c1-13(17-12-16(23-3)10-11-18(17)24-4)20-14(2)19(22)21-15-8-6-5-7-9-15/h5-14,20H,1-4H3,(H,21,22)
InChIKeyBSGJYZKMHJQPPB-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.38
Rot. Bonds7

About 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide

2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide (PubChem CID 51226942) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide.

Molecular Properties

Compound Name2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide
PubChem CID51226942
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide
SMILESCOc1ccc(OC)c(C(C)NC(C)C(=O)Nc2ccccc2)c1
InChIInChI=1S/C19H24N2O3/c1-13(17-12-16(23-3)10-11-18(17)24-4)20-14(2)19(22)21-15-8-6-5-7-9-15/h5-14,20H,1-4H3,(H,21,22)
InChIKeyBSGJYZKMHJQPPB-UHFFFAOYSA-N
XLogP3.38
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-N-(4-nitrophenyl)propanamide
CID 26642114
N-(2-chlorophenyl)-2-[1-(2,5-dimethoxyphenyl)ethylamino]propanamide
CID 51245585
2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
CID 45351312
(2S)-N-(4-methoxyphenyl)-2-[[(1R)-1-phenylethyl]amino]propanamide
CID 9248611
2-[1-(2,5-dimethoxyphenyl)ethylamino]-N,N-dimethylpropanamide
CID 43401048
(2R)-N-[4-(dimethylamino)phenyl]-2-[[(1S)-1-(2-methoxyphenyl)ethyl]amino]propanamide
CID 25363076
2-anilino-N-[1-(2,5-dimethoxyphenyl)ethyl]acetamide
CID 119691812
2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]propanamide
CID 51245605
(2S)-N-(3,5-dimethoxyphenyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]propanamide
CID 40800165
N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-phenylacetamide
CID 40553494
2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-[5-(dimethylsulfamoyl)-2-methylphenyl]propanamide
CID 17478550
(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide
CID 8545508

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide?
The IUPAC name of 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide (CID 51226942) is 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide.
What is the SMILES notation for 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide?
The canonical SMILES for 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide is COc1ccc(OC)c(C(C)NC(C)C(=O)Nc2ccccc2)c1.
What is the InChIKey of 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide?
The InChIKey is BSGJYZKMHJQPPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-13(17-12-16(23-3)10-11-18(17)24-4)20-14(2)19(22)21-15-8-6-5-7-9-15/h5-14,20H,1-4H3,(H,21,22).
What are the key properties of 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide?
2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide has a molecular weight of 328.41 g/mol, XLogP of 3.38, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,5-dimethoxyphenyl)ethylamino]-N-phenylpropanamide is sourced from PubChem (CID 51226942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).