2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide

C22H31N3O — CID 119849948

IUPAC2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide
SMILESCCN(CC)C(CNC(=O)C(N)Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C22H31N3O/c1-3-25(4-2)20(15-18-11-7-5-8-12-18)17-24-22(26)21(23)16-19-13-9-6-10-14-19/h5-14,20-21H,3-4,15-17,23H2,1-2H3,(H,24,26)
InChIKeyQJBHPHYPVRMEIH-UHFFFAOYSA-N
MW353.51 g/mol
LogP2.63
Rot. Bonds10

About 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide

2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide (PubChem CID 119849948) has the molecular formula C22H31N3O and a molecular weight of 353.51 g/mol. Its IUPAC name is 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide
PubChem CID119849948
Molecular FormulaC22H31N3O
Molecular Weight353.51 g/mol
Exact Mass353.25
IUPAC Name2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide
SMILESCCN(CC)C(CNC(=O)C(N)Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C22H31N3O/c1-3-25(4-2)20(15-18-11-7-5-8-12-18)17-24-22(26)21(23)16-19-13-9-6-10-14-19/h5-14,20-21H,3-4,15-17,23H2,1-2H3,(H,24,26)
InChIKeyQJBHPHYPVRMEIH-UHFFFAOYSA-N
XLogP2.63
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.51
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(diethylamino)-3-phenylpropyl]-2-methylpropanamide
CID 119849944
(2S)-2-amino-N-[2-(dimethylamino)-4-methylpentyl]-3-phenylpropanamide
CID 61274682
2-amino-N-(2-methylbutyl)-3-phenylpropanamide
CID 55108121
2-amino-N-(2-hydroxypropyl)-3-phenylpropanamide
CID 43500101
2-[[[(2S)-2-amino-3-phenylpropanoyl]amino]methyl]pentanoic acid
CID 65223842
2-amino-N-ethyl-3-phenylpropanamide;hydrochloride
CID 53409094
2-amino-N-[2-(diethylamino)-3-phenylpropyl]benzamide
CID 119946555
2-amino-N-[2-(diethylamino)-2-thiophen-3-ylethyl]-3-phenylpropanamide;dihydrochloride
CID 119849739
(2R)-2-amino-N-(2,3-dimethylbutyl)-3-phenylpropanamide
CID 78996657
1-amino-N-[2-(diethylamino)-3-phenylpropyl]cyclopentane-1-carboxamide
CID 119849960
(2R)-2-amino-N-(2-hydroxypentyl)-3-phenylpropanamide
CID 103796801
(2R)-2-amino-N-(2-hydroxy-3-methylbutyl)-3-phenylpropanamide
CID 113492232

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide?
The IUPAC name of 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide (CID 119849948) is 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide is CCN(CC)C(CNC(=O)C(N)Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide?
The InChIKey is QJBHPHYPVRMEIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31N3O/c1-3-25(4-2)20(15-18-11-7-5-8-12-18)17-24-22(26)21(23)16-19-13-9-6-10-14-19/h5-14,20-21H,3-4,15-17,23H2,1-2H3,(H,24,26).
What are the key properties of 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide?
2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide has a molecular weight of 353.51 g/mol, XLogP of 2.63, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide is sourced from PubChem (CID 119849948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).