2-amino-3-methoxy-N-(2-phenylpropyl)propanamide

C13H20N2O2 — CID 81089279

IUPAC2-amino-3-methoxy-N-(2-phenylpropyl)propanamide
SMILESCOCC(N)C(=O)NCC(C)c1ccccc1
InChIInChI=1S/C13H20N2O2/c1-10(11-6-4-3-5-7-11)8-15-13(16)12(14)9-17-2/h3-7,10,12H,8-9,14H2,1-2H3,(H,15,16)
InChIKeyMABIOTGYPDJGTC-UHFFFAOYSA-N
MW236.31 g/mol
LogP0.88
Rot. Bonds6

About 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide

2-amino-3-methoxy-N-(2-phenylpropyl)propanamide (PubChem CID 81089279) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide.

Molecular Properties

Compound Name2-amino-3-methoxy-N-(2-phenylpropyl)propanamide
PubChem CID81089279
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-amino-3-methoxy-N-(2-phenylpropyl)propanamide
SMILESCOCC(N)C(=O)NCC(C)c1ccccc1
InChIInChI=1S/C13H20N2O2/c1-10(11-6-4-3-5-7-11)8-15-13(16)12(14)9-17-2/h3-7,10,12H,8-9,14H2,1-2H3,(H,15,16)
InChIKeyMABIOTGYPDJGTC-UHFFFAOYSA-N
XLogP0.88
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide 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

(2S)-2-amino-N-(2-phenylpropyl)butanamide;hydrochloride
CID 119270188
2-amino-N-(2-phenylpropyl)propanamide
CID 60703339
ethyl 3-[(2-amino-3-methoxypropanoyl)amino]-2-phenylpropanoate
CID 120990918
2-amino-3-methoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)propanamide
CID 81071617
[(2S)-1-oxo-1-[[(2R)-2-phenylpropyl]amino]propan-2-yl] 2,2-diphenylacetate
CID 8578724
(2S,3S)-2-amino-3-methyl-N-(2-phenylpropyl)pentanamide
CID 61251907
2-[2-[[(2-amino-3-methoxypropanoyl)amino]methyl]phenyl]acetic acid
CID 81317772
2-amino-3-methoxy-N-(2-phenoxyethyl)propanamide
CID 81089075
2-chloro-N-(2-phenylpropyl)propanamide
CID 4961581
(2R)-2-amino-N-(3-methoxy-2-methylpropyl)-3-phenylpropanamide
CID 78985598
(2S)-2-amino-N-(2-methoxy-2-phenylethyl)-4-methylpentanamide;hydrochloride
CID 119703944
2-amino-3-methoxy-N-(3-methoxy-2-methylpropyl)propanamide
CID 81089502

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide?
The IUPAC name of 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide (CID 81089279) is 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide.
What is the SMILES notation for 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide?
The canonical SMILES for 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide is COCC(N)C(=O)NCC(C)c1ccccc1.
What is the InChIKey of 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide?
The InChIKey is MABIOTGYPDJGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10(11-6-4-3-5-7-11)8-15-13(16)12(14)9-17-2/h3-7,10,12H,8-9,14H2,1-2H3,(H,15,16).
What are the key properties of 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide?
2-amino-3-methoxy-N-(2-phenylpropyl)propanamide has a molecular weight of 236.31 g/mol, XLogP of 0.88, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxy-N-(2-phenylpropyl)propanamide is sourced from PubChem (CID 81089279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).