2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide

C14H22N2O3 — CID 79796473

IUPAC2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide
SMILESCCC(C)(N)C(=O)Nc1cc(OC)c(OC)cc1C
InChIInChI=1S/C14H22N2O3/c1-6-14(3,15)13(17)16-10-8-12(19-5)11(18-4)7-9(10)2/h7-8H,6,15H2,1-5H3,(H,16,17)
InChIKeyOLDDGSYMWAAFDJ-UHFFFAOYSA-N
MW266.34 g/mol
LogP2.08
Rot. Bonds5

About 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide

2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide (PubChem CID 79796473) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide.

Molecular Properties

Compound Name2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide
PubChem CID79796473
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide
SMILESCCC(C)(N)C(=O)Nc1cc(OC)c(OC)cc1C
InChIInChI=1S/C14H22N2O3/c1-6-14(3,15)13(17)16-10-8-12(19-5)11(18-4)7-9(10)2/h7-8H,6,15H2,1-5H3,(H,16,17)
InChIKeyOLDDGSYMWAAFDJ-UHFFFAOYSA-N
XLogP2.08
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-methoxy-4-methylphenyl)-2-methylbutanamide
CID 79805209
2-amino-N-(2,5-dimethylphenyl)-2-methylbutanamide
CID 79797135
(4,5-dimethoxy-2-methylphenyl)urea
CID 82492626
2-amino-N-(4-bromo-2-methylphenyl)-2-methylbutanamide
CID 79791633
2-amino-N-(5-fluoro-2-methylphenyl)-2-methylbutanamide
CID 79796953
2-amino-N-(2-fluoro-4,5-dimethoxyphenyl)-2-methylpentanamide
CID 119778135
N-(4-acetamido-3-methoxyphenyl)-2-amino-2-methylbutanamide
CID 79797274
2-amino-2-methyl-N-(4-methylthiophen-3-yl)butanamide
CID 131043496
(2S)-2-amino-N-(4,5-dimethoxy-2-methylphenyl)butanamide
CID 79024477
ethyl 4-(4,5-dimethoxy-2-methylanilino)-4-oxobutanoate
CID 28538834
2-amino-2-methyl-N-(2,4,6-trimethylphenyl)butanamide
CID 79789969
3-amino-4-(4,5-dimethoxy-2-methylanilino)-4-oxobutanoic acid
CID 64895496

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide?
The IUPAC name of 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide (CID 79796473) is 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide.
What is the SMILES notation for 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide?
The canonical SMILES for 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide is CCC(C)(N)C(=O)Nc1cc(OC)c(OC)cc1C.
What is the InChIKey of 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide?
The InChIKey is OLDDGSYMWAAFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-6-14(3,15)13(17)16-10-8-12(19-5)11(18-4)7-9(10)2/h7-8H,6,15H2,1-5H3,(H,16,17).
What are the key properties of 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide?
2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide has a molecular weight of 266.34 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4,5-dimethoxy-2-methylphenyl)-2-methylbutanamide is sourced from PubChem (CID 79796473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).