3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine

C15H25N — CID 63716659

IUPAC3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine
SMILESCCC(C)C(N)Cc1c(C)cc(C)cc1C
InChIInChI=1S/C15H25N/c1-6-11(3)15(16)9-14-12(4)7-10(2)8-13(14)5/h7-8,11,15H,6,9,16H2,1-5H3
InChIKeyWLKPDXZNNOHVFE-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.53
Rot. Bonds4

About 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine

3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine (PubChem CID 63716659) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine.

Molecular Properties

Compound Name3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine
PubChem CID63716659
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine
SMILESCCC(C)C(N)Cc1c(C)cc(C)cc1C
InChIInChI=1S/C15H25N/c1-6-11(3)15(16)9-14-12(4)7-10(2)8-13(14)5/h7-8,11,15H,6,9,16H2,1-5H3
InChIKeyWLKPDXZNNOHVFE-UHFFFAOYSA-N
XLogP3.53
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine 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

4,4,4-trifluoro-3-(trifluoromethyl)-1-(2,4,6-trimethylphenyl)butan-2-amine
CID 103311794
3-methyl-4-(2,4,6-trimethylphenyl)butan-2-ol
CID 11229524
3-methoxy-1-(2,4,6-trimethylphenyl)butan-2-ol
CID 79616533
1-(2,4,6-trimethylphenyl)heptan-4-amine
CID 64502731
3-methyl-1-(3-methylphenyl)pentan-2-amine
CID 62388327
4-methoxy-1-(2,4,6-trimethylphenyl)pentan-2-amine
CID 113391370
2-(2,2-diethoxyethyl)-1,3,5-trimethylbenzene
CID 146004844
dimethyl 2-[(2,4,6-trimethylphenyl)methyl]propanedioate
CID 94276263
(1S,2R)-1-amino-3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-ol;hydrochloride
CID 171268351
(2S,3S)-1-N-(3,5-dimethylphenyl)-3-methylpentane-1,2-diamine
CID 71019513
(2S)-2-amino-3-(2,4,6-trimethylphenyl)propanal
CID 54309982
2-amino-3-(2,4,6-trimethylphenyl)propan-1-ol;hydrochloride
CID 170891844

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine?
The IUPAC name of 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine (CID 63716659) is 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine.
What is the SMILES notation for 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine?
The canonical SMILES for 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine is CCC(C)C(N)Cc1c(C)cc(C)cc1C.
What is the InChIKey of 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine?
The InChIKey is WLKPDXZNNOHVFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-6-11(3)15(16)9-14-12(4)7-10(2)8-13(14)5/h7-8,11,15H,6,9,16H2,1-5H3.
What are the key properties of 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine?
3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine has a molecular weight of 219.37 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine is sourced from PubChem (CID 63716659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).