2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine

C15H25N — CID 82472490

IUPAC2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine
SMILESCc1cc(C(C)(C)C)ccc1C(C)(C)CN
InChIInChI=1S/C15H25N/c1-11-9-12(14(2,3)4)7-8-13(11)15(5,6)10-16/h7-9H,10,16H2,1-6H3
InChIKeyPYZMITWNFFIWQG-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.53
Rot. Bonds2

About 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine

2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine (PubChem CID 82472490) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine
PubChem CID82472490
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine
SMILESCc1cc(C(C)(C)C)ccc1C(C)(C)CN
InChIInChI=1S/C15H25N/c1-11-9-12(14(2,3)4)7-8-13(11)15(5,6)10-16/h7-9H,10,16H2,1-6H3
InChIKeyPYZMITWNFFIWQG-UHFFFAOYSA-N
XLogP3.53
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
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 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-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

3-(4-tert-butyl-2-methylphenyl)-3,3-difluoro-2,2-dimethylpropan-1-amine
CID 116839672
2-(2,3-difluoro-4-methylphenyl)-2-methylpropan-1-amine
CID 107514700
2-(5-tert-butyl-1H-indol-3-yl)-2-methylpropan-1-amine
CID 82497725
2-(5-tert-butyl-2-methylphenyl)-2-methoxypropan-1-amine
CID 82291390
4-tert-butyl-1-(1,1-difluoropropyl)-2-methylbenzene
CID 116841304
2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine;hydrochloride
CID 74889721
(2,4-ditert-butylphenyl)methanamine
CID 174492091
2-(2-fluoro-3-methylphenyl)-2-methylpropan-1-amine
CID 83696433
2-methyl-2-(4-methylphenyl)propan-1-amine;propane
CID 143028408
2-(4-tert-butyl-2-methylphenyl)-N,2-dimethylpropanehydrazide
CID 116845949
4-(1-amino-2-methylpropan-2-yl)-3-chloroaniline
CID 69044603
2-[3-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine
CID 57243357

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine?
The IUPAC name of 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine (CID 82472490) is 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine.
What is the SMILES notation for 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine?
The canonical SMILES for 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine is Cc1cc(C(C)(C)C)ccc1C(C)(C)CN.
What is the InChIKey of 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine?
The InChIKey is PYZMITWNFFIWQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-11-9-12(14(2,3)4)7-8-13(11)15(5,6)10-16/h7-9H,10,16H2,1-6H3.
What are the key properties of 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine?
2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine has a molecular weight of 219.37 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butyl-2-methylphenyl)-2-methylpropan-1-amine is sourced from PubChem (CID 82472490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).