3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide

C15H24N2O — CID 115154822

IUPAC3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide
SMILESCc1cc(C)c(C)c(NC(=O)CC(C)(C)N)c1C
InChIInChI=1S/C15H24N2O/c1-9-7-10(2)12(4)14(11(9)3)17-13(18)8-15(5,6)16/h7H,8,16H2,1-6H3,(H,17,18)
InChIKeyJVAXLQYWLYPKJP-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.99
Rot. Bonds3

About 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide

3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide (PubChem CID 115154822) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide.

Molecular Properties

Compound Name3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide
PubChem CID115154822
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide
SMILESCc1cc(C)c(C)c(NC(=O)CC(C)(C)N)c1C
InChIInChI=1S/C15H24N2O/c1-9-7-10(2)12(4)14(11(9)3)17-13(18)8-15(5,6)16/h7H,8,16H2,1-6H3,(H,17,18)
InChIKeyJVAXLQYWLYPKJP-UHFFFAOYSA-N
XLogP2.99
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide 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

2-amino-N-(2,3,5,6-tetramethylphenyl)acetamide
CID 82492252
5-[(3-amino-3-methylbutanoyl)amino]-2,3-dimethylbenzoic acid
CID 64676851
3-amino-N-(2,6-difluorophenyl)-3-methylbutanamide
CID 64684364
(2,3,5,6-tetramethylphenyl)carbamic acid
CID 115170617
N-(3-acetamido-4-methylphenyl)-3-amino-3-methylbutanamide
CID 64684853
3-amino-3-methyl-N-(5-methyl-1H-pyrazol-3-yl)butanamide
CID 64678472
3-amino-N-(2-iodophenyl)-3-methylbutanamide
CID 64684765
2-[(3-amino-3-methylbutanoyl)amino]-6-methylbenzoic acid
CID 64676890
3-amino-N-(2-bromo-6-fluorophenyl)-3-methylbutanamide
CID 107599929
3-amino-3-methyl-N-(4-methylsulfonylphenyl)butanamide
CID 64683356
3-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)-3-methylbutanamide
CID 113433629
3-amino-3-methyl-N-(5-methyl-1H-pyrazol-4-yl)butanamide
CID 83618200

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide?
The IUPAC name of 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide (CID 115154822) is 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide.
What is the SMILES notation for 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide?
The canonical SMILES for 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide is Cc1cc(C)c(C)c(NC(=O)CC(C)(C)N)c1C.
What is the InChIKey of 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide?
The InChIKey is JVAXLQYWLYPKJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-9-7-10(2)12(4)14(11(9)3)17-13(18)8-15(5,6)16/h7H,8,16H2,1-6H3,(H,17,18).
What are the key properties of 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide?
3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide has a molecular weight of 248.37 g/mol, XLogP of 2.99, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-methyl-N-(2,3,5,6-tetramethylphenyl)butanamide is sourced from PubChem (CID 115154822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).