N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide

C19H24N2O — CID 4781429

IUPACN-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide
SMILESCCCNC(C(=O)Nc1cc(C)ccc1C)c1ccccc1
InChIInChI=1S/C19H24N2O/c1-4-12-20-18(16-8-6-5-7-9-16)19(22)21-17-13-14(2)10-11-15(17)3/h5-11,13,18,20H,4,12H2,1-3H3,(H,21,22)
InChIKeyMBSGOSNNUZUOFI-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.98
Rot. Bonds6

About N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide

N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide (PubChem CID 4781429) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide
PubChem CID4781429
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide
SMILESCCCNC(C(=O)Nc1cc(C)ccc1C)c1ccccc1
InChIInChI=1S/C19H24N2O/c1-4-12-20-18(16-8-6-5-7-9-16)19(22)21-17-13-14(2)10-11-15(17)3/h5-11,13,18,20H,4,12H2,1-3H3,(H,21,22)
InChIKeyMBSGOSNNUZUOFI-UHFFFAOYSA-N
XLogP3.98
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(2,5-dimethylphenyl)-2-(2-methylpropylamino)-2-phenylacetamide
CID 2396119
(2S)-N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylamino]-2-phenylacetamide
CID 7928830
(2R)-N-(2,5-dimethylphenyl)-2-(4-methylanilino)-2-phenylacetamide
CID 7778075
(2R)-N-(2,5-dimethylphenyl)-2-(4-ethylanilino)-2-phenylacetamide
CID 7928697
(2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 92509537
N-(2,5-dimethylphenyl)-2-phenyl-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 4848816
(2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-[[2-(piperidin-1-ylmethyl)phenyl]methylamino]acetamide
CID 40811390
(2S,3R)-N-(2,5-dimethylphenyl)-3-methyl-2-phenylpentanamide
CID 8712534
(2S)-2-(1,3-benzodioxol-5-ylmethylamino)-N-(2,5-dimethylphenyl)-2-phenylacetamide
CID 41143433
(2R)-N-(2,5-dimethylphenyl)-2-(2-methoxyanilino)-2-phenylacetamide
CID 9345391
(2R)-N-(2,5-dimethylphenyl)-2-[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methylamino]-2-phenylacetamide
CID 41436019
(2R)-2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-N-(2,5-dimethylphenyl)-2-phenylacetamide
CID 9307161

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide?
The IUPAC name of N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide (CID 4781429) is N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide is CCCNC(C(=O)Nc1cc(C)ccc1C)c1ccccc1.
What is the InChIKey of N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide?
The InChIKey is MBSGOSNNUZUOFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-4-12-20-18(16-8-6-5-7-9-16)19(22)21-17-13-14(2)10-11-15(17)3/h5-11,13,18,20H,4,12H2,1-3H3,(H,21,22).
What are the key properties of N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide?
N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide has a molecular weight of 296.41 g/mol, XLogP of 3.98, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-2-phenyl-2-(propylamino)acetamide is sourced from PubChem (CID 4781429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).