2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride

C17H29Cl2N3O2 — CID 119868997

IUPAC2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride
SMILESCC(CNC(=O)C(N)Cc1ccccc1)CN1CCOCC1.Cl.Cl
InChIInChI=1S/C17H27N3O2.2ClH/c1-14(13-20-7-9-22-10-8-20)12-19-17(21)16(18)11-15-5-3-2-4-6-15;;/h2-6,14,16H,7-13,18H2,1H3,(H,19,21);2*1H
InChIKeyDNYKXAOJNMBNDY-UHFFFAOYSA-N
MW378.34 g/mol
LogP1.48
Rot. Bonds7

About 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride

2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride (PubChem CID 119868997) has the molecular formula C17H29Cl2N3O2 and a molecular weight of 378.34 g/mol. Its IUPAC name is 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride
PubChem CID119868997
Molecular FormulaC17H29Cl2N3O2
Molecular Weight378.34 g/mol
Exact Mass377.16
IUPAC Name2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride
SMILESCC(CNC(=O)C(N)Cc1ccccc1)CN1CCOCC1.Cl.Cl
InChIInChI=1S/C17H27N3O2.2ClH/c1-14(13-20-7-9-22-10-8-20)12-19-17(21)16(18)11-15-5-3-2-4-6-15;;/h2-6,14,16H,7-13,18H2,1H3,(H,19,21);2*1H
InChIKeyDNYKXAOJNMBNDY-UHFFFAOYSA-N
XLogP1.48
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.34
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-(2-morpholin-4-yl-2-phenylethyl)-3-phenylpropanamide;dihydrochloride
CID 119853212
2-amino-N-(2-methylbutyl)-3-phenylpropanamide
CID 55108121
2-amino-N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide;dihydrochloride
CID 119867130
(2S)-2-amino-3-phenyl-N-(1-piperidin-1-ylpropan-2-yl)propanamide;dihydrochloride
CID 119851464
2-amino-N-(2-hydroxypropyl)-3-phenylpropanamide
CID 43500101
(2R)-2-amino-N-(3-methoxy-2-methylpropyl)-3-phenylpropanamide
CID 78985598
2-amino-3-phenyl-N-(2-piperidin-1-ylpropyl)propanamide
CID 61017950
2-amino-3-phenyl-N-(1-piperidin-1-ylpropan-2-yl)propanamide
CID 43695355
(2R)-2-amino-N-(2,3-dimethylbutyl)-3-phenylpropanamide
CID 78996657
4-amino-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)pentanamide;dihydrochloride
CID 120565520
(3S)-3-benzyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pyrrolidine-1-carboxamide
CID 95945322
(2S)-2-methoxy-N-[(2R)-1-morpholin-4-yl-3-phenylpropan-2-yl]propanamide
CID 95621536

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride?
The IUPAC name of 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride (CID 119868997) is 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride.
What is the SMILES notation for 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride?
The canonical SMILES for 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride is CC(CNC(=O)C(N)Cc1ccccc1)CN1CCOCC1.Cl.Cl.
What is the InChIKey of 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride?
The InChIKey is DNYKXAOJNMBNDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O2.2ClH/c1-14(13-20-7-9-22-10-8-20)12-19-17(21)16(18)11-15-5-3-2-4-6-15;;/h2-6,14,16H,7-13,18H2,1H3,(H,19,21);2*1H.
What are the key properties of 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride?
2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride has a molecular weight of 378.34 g/mol, XLogP of 1.48, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methyl-3-morpholin-4-ylpropyl)-3-phenylpropanamide;dihydrochloride is sourced from PubChem (CID 119868997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).