2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide

C12H18N2O2 — CID 81082397

IUPAC2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)Nc1ccc(C)cc1C
InChIInChI=1S/C12H18N2O2/c1-8-4-5-11(9(2)6-8)14-12(15)10(13)7-16-3/h4-6,10H,7,13H2,1-3H3,(H,14,15)
InChIKeyAVWCFVBKKFRATE-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.22
Rot. Bonds4

About 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide

2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide (PubChem CID 81082397) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide.

Molecular Properties

Compound Name2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide
PubChem CID81082397
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)Nc1ccc(C)cc1C
InChIInChI=1S/C12H18N2O2/c1-8-4-5-11(9(2)6-8)14-12(15)10(13)7-16-3/h4-6,10H,7,13H2,1-3H3,(H,14,15)
InChIKeyAVWCFVBKKFRATE-UHFFFAOYSA-N
XLogP1.22
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3-methoxy-N-[2-methyl-4-(1-phenylethoxy)phenyl]propanamide
CID 120988950
2-amino-3-methoxy-N-(5-methoxy-2-methylphenyl)propanamide
CID 114252735
2-amino-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-methoxypropanamide
CID 120983378
2-amino-N-[5-(2,4-dimethylphenyl)-1,3,4-thiadiazol-2-yl]-3-methoxypropanamide
CID 120987607
2-amino-N-(3,4-dimethylphenyl)-3-methoxypropanamide
CID 81081537
1-(2,4-dimethylphenyl)-3-(2-methoxyethyl)urea
CID 5054028
2-amino-3-methoxy-N-(4-methyl-3-pyridinyl)propanamide
CID 81089004
2-amino-N-[2-(2-methoxyethoxy)-4-methylphenyl]butanamide
CID 54862844
2-amino-N-(2,4-dimethylphenyl)-3,3-dimethylbutanamide
CID 76892717
4-[(2-amino-3-methoxypropanoyl)amino]-3-chlorobenzoic acid
CID 81089429
(2S)-2-amino-N-[2-(2-methoxyethoxy)-4-methylphenyl]pentanamide
CID 107568802
ethyl 4-[(2-amino-3-methoxypropanoyl)amino]-3-bromobenzoate
CID 81082689

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide?
The IUPAC name of 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide (CID 81082397) is 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide.
What is the SMILES notation for 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide?
The canonical SMILES for 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide is COCC(N)C(=O)Nc1ccc(C)cc1C.
What is the InChIKey of 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide?
The InChIKey is AVWCFVBKKFRATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-8-4-5-11(9(2)6-8)14-12(15)10(13)7-16-3/h4-6,10H,7,13H2,1-3H3,(H,14,15).
What are the key properties of 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide?
2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide has a molecular weight of 222.29 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,4-dimethylphenyl)-3-methoxypropanamide is sourced from PubChem (CID 81082397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).