3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide

C15H24N2O2 — CID 115154910

IUPAC3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide
SMILESCCOc1ccc(N(C)C(=O)CC(C)(C)N)cc1C
InChIInChI=1S/C15H24N2O2/c1-6-19-13-8-7-12(9-11(13)2)17(5)14(18)10-15(3,4)16/h7-9H,6,10,16H2,1-5H3
InChIKeyUQFWUTSJJGSZKN-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.48
Rot. Bonds5

About 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide

3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide (PubChem CID 115154910) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide.

Molecular Properties

Compound Name3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide
PubChem CID115154910
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide
SMILESCCOc1ccc(N(C)C(=O)CC(C)(C)N)cc1C
InChIInChI=1S/C15H24N2O2/c1-6-19-13-8-7-12(9-11(13)2)17(5)14(18)10-15(3,4)16/h7-9H,6,10,16H2,1-5H3
InChIKeyUQFWUTSJJGSZKN-UHFFFAOYSA-N
XLogP2.48
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethoxy-3-methylphenyl)-N-methyl-2-oxoacetamide
CID 115166060
N-(4-ethoxy-3-methylphenyl)-4-hydroxy-N-methylbutanamide
CID 115162888
4-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide
CID 115156304
3-amino-N-(3-fluoro-4-methoxyphenyl)-N,3-dimethylbutanamide
CID 115154887
3-amino-N-[(4-ethoxy-3-methylphenyl)methyl]-3-methylbutanamide
CID 115154979
3-N-(4-ethoxy-3-methylphenyl)-3-N,3-dimethylbutane-1,3-diamine
CID 115134578
3-amino-N,3-dimethyl-N-(1-methylbenzimidazol-5-yl)butanamide
CID 115154935
4-ethoxy-N,3-dimethyl-N-(2,2,2-trifluoroethyl)aniline
CID 115257768
4-ethoxy-N-(hydrazinylmethyl)-N,3-dimethylaniline
CID 115260617
N-(3,4-dimethoxyphenyl)-N,3,3-trimethylbutanamide
CID 110425453
ethyl 3-oxo-3-(N,3,4-trimethylanilino)propanoate
CID 115138487
4-(4-ethoxy-3-methylphenyl)-2-methylbutan-2-amine
CID 96659154

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide?
The IUPAC name of 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide (CID 115154910) is 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide.
What is the SMILES notation for 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide?
The canonical SMILES for 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide is CCOc1ccc(N(C)C(=O)CC(C)(C)N)cc1C.
What is the InChIKey of 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide?
The InChIKey is UQFWUTSJJGSZKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-6-19-13-8-7-12(9-11(13)2)17(5)14(18)10-15(3,4)16/h7-9H,6,10,16H2,1-5H3.
What are the key properties of 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide?
3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide has a molecular weight of 264.37 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-ethoxy-3-methylphenyl)-N,3-dimethylbutanamide is sourced from PubChem (CID 115154910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).