2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide

C12H18N2O3 — CID 114252735

IUPAC2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide
SMILESCOCC(N)C(=O)Nc1cc(OC)ccc1C
InChIInChI=1S/C12H18N2O3/c1-8-4-5-9(17-3)6-11(8)14-12(15)10(13)7-16-2/h4-6,10H,7,13H2,1-3H3,(H,14,15)
InChIKeyQOTLHFNSZLLNNC-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.92
Rot. Bonds5

About 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide

2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide (PubChem CID 114252735) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide.

Molecular Properties

Compound Name2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide
PubChem CID114252735
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide
SMILESCOCC(N)C(=O)Nc1cc(OC)ccc1C
InChIInChI=1S/C12H18N2O3/c1-8-4-5-9(17-3)6-11(8)14-12(15)10(13)7-16-2/h4-6,10H,7,13H2,1-3H3,(H,14,15)
InChIKeyQOTLHFNSZLLNNC-UHFFFAOYSA-N
XLogP0.92
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide
CID 81082397
2-amino-N-(3,4-dimethylphenyl)-3-methoxypropanamide
CID 81081537
2-amino-3-methoxy-N-(4-methyl-3-pyridinyl)propanamide
CID 81089004
3-(ethylamino)-N-(5-methoxy-2-methylphenyl)-2-methylpropanamide
CID 114252727
2-[(2-amino-4-methoxybutanoyl)amino]-4-methoxybenzoic acid
CID 115411605
2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride
CID 119263329
2-amino-N-(2-chloro-5-methoxyphenyl)-5-methoxypentanamide
CID 81089395
2-amino-3-methoxy-N-[2-methyl-4-(1-phenylethoxy)phenyl]propanamide
CID 120988950
2-amino-N-(4-methoxy-2-methylphenyl)hexanamide
CID 62871713
2-[3-(2-aminobutanoylamino)-4-methylphenoxy]ethyl nitrate;hydrochloride
CID 70499880
(2S)-2-amino-N-(2-hydroxy-5-methoxyphenyl)pentanamide
CID 107570852
2-amino-3-methoxy-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]propanamide
CID 120984258

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide?
The IUPAC name of 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide (CID 114252735) is 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide.
What is the SMILES notation for 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide?
The canonical SMILES for 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide is COCC(N)C(=O)Nc1cc(OC)ccc1C.
What is the InChIKey of 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide?
The InChIKey is QOTLHFNSZLLNNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-8-4-5-9(17-3)6-11(8)14-12(15)10(13)7-16-2/h4-6,10H,7,13H2,1-3H3,(H,14,15).
What are the key properties of 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide?
2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide has a molecular weight of 238.29 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide is sourced from PubChem (CID 114252735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).