2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide

C17H21N3O — CID 43710155

IUPAC2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide
SMILESCN(C)c1ccccc1NC(=O)C(N)Cc1ccccc1
InChIInChI=1S/C17H21N3O/c1-20(2)16-11-7-6-10-15(16)19-17(21)14(18)12-13-8-4-3-5-9-13/h3-11,14H,12,18H2,1-2H3,(H,19,21)
InChIKeyYMGMJLXCSITABE-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.26
Rot. Bonds5

About 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide

2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide (PubChem CID 43710155) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide
PubChem CID43710155
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide
SMILESCN(C)c1ccccc1NC(=O)C(N)Cc1ccccc1
InChIInChI=1S/C17H21N3O/c1-20(2)16-11-7-6-10-15(16)19-17(21)14(18)12-13-8-4-3-5-9-13/h3-11,14H,12,18H2,1-2H3,(H,19,21)
InChIKeyYMGMJLXCSITABE-UHFFFAOYSA-N
XLogP2.26
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide
CID 78984805
(2S)-2-amino-N-(2-methylphenyl)-3-phenylpropanamide
CID 22691205
(2S)-2-amino-N-(2-hydroxy-3-methylphenyl)-3-phenylpropanamide
CID 79602874
(2S)-2-amino-N-[(2S)-2-amino-3-phenylpropanoyl]-3-phenylpropanamide
CID 21116073
(2S)-2-amino-N-(2-methyl-3-pyridinyl)-3-phenylpropanamide
CID 54173969
1-benzyl-3-[2-(dimethylamino)phenyl]urea
CID 47202175
(2S)-2-amino-N-[2-(dimethylamino)phenyl]-3,3-dimethylbutanamide
CID 61179694
(2R)-2-amino-N-(2,3,4,5,6-pentamethylphenyl)-3-phenylpropanamide
CID 124864491
(2S)-2-amino-N-(5-methyl-1H-pyrazol-4-yl)-3-phenylpropanamide
CID 110837650
(2S)-2-amino-N-(4-hydroxy-2-methylphenyl)-3-phenylpropanamide
CID 78995809
methyl (2S)-2-[[2-(dimethylamino)phenyl]carbamoyl]butanoate
CID 99801098
methyl (2R)-2-[[2-(dimethylamino)phenyl]carbamoyl]butanoate
CID 99801099

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide?
The IUPAC name of 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide (CID 43710155) is 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide is CN(C)c1ccccc1NC(=O)C(N)Cc1ccccc1.
What is the InChIKey of 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide?
The InChIKey is YMGMJLXCSITABE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-20(2)16-11-7-6-10-15(16)19-17(21)14(18)12-13-8-4-3-5-9-13/h3-11,14H,12,18H2,1-2H3,(H,19,21).
What are the key properties of 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide?
2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide has a molecular weight of 283.38 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide is sourced from PubChem (CID 43710155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).