2-(4-tert-butylphenyl)-3-methylbutan-2-amine

C15H25N — CID 62548190

IUPAC2-(4-tert-butylphenyl)-3-methylbutan-2-amine
SMILESCC(C)C(C)(N)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H25N/c1-11(2)15(6,16)13-9-7-12(8-10-13)14(3,4)5/h7-11H,16H2,1-6H3
InChIKeyOTEKRIBAZZXJLZ-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.81
Rot. Bonds2

About 2-(4-tert-butylphenyl)-3-methylbutan-2-amine

2-(4-tert-butylphenyl)-3-methylbutan-2-amine (PubChem CID 62548190) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-3-methylbutan-2-amine.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)-3-methylbutan-2-amine
PubChem CID62548190
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name2-(4-tert-butylphenyl)-3-methylbutan-2-amine
SMILESCC(C)C(C)(N)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H25N/c1-11(2)15(6,16)13-9-7-12(8-10-13)14(3,4)5/h7-11H,16H2,1-6H3
InChIKeyOTEKRIBAZZXJLZ-UHFFFAOYSA-N
XLogP3.81
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 ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-bromophenyl)-3-methylbutan-2-amine;hydrochloride
CID 75525874
3-(4-tert-butylphenyl)-2-methylpentan-3-amine
CID 63408030
1-tert-butyl-4-(2,3-dimethylbutan-2-yl)benzene;ethane
CID 145287481
3-methyl-2-pyrimidin-5-ylbutan-2-amine
CID 62490882
1,4-ditert-butylbenzene;bis(2,2-dimethylpropane);ethane
CID 162101087
N"-(4-tert-butylphenyl)methanetriamine
CID 166823886
1-(4-tert-butylphenyl)propane-1,2-diamine
CID 20546388
(2S)-2-phenylbutane-2,3-diamine
CID 175403934
5-(2-amino-3-methylbutan-2-yl)-1-methyl-3H-indol-2-one
CID 82289779
2-(4-tert-butylphenyl)-2,3-dimethylbutanoyl chloride
CID 117048087
2-(4-tert-butylphenyl)-2,3-dimethylbutanenitrile
CID 117048002
2-(4-tert-butylphenyl)butan-2-amine
CID 62548189

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)-3-methylbutan-2-amine?
The IUPAC name of 2-(4-tert-butylphenyl)-3-methylbutan-2-amine (CID 62548190) is 2-(4-tert-butylphenyl)-3-methylbutan-2-amine.
What is the SMILES notation for 2-(4-tert-butylphenyl)-3-methylbutan-2-amine?
The canonical SMILES for 2-(4-tert-butylphenyl)-3-methylbutan-2-amine is CC(C)C(C)(N)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of 2-(4-tert-butylphenyl)-3-methylbutan-2-amine?
The InChIKey is OTEKRIBAZZXJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-11(2)15(6,16)13-9-7-12(8-10-13)14(3,4)5/h7-11H,16H2,1-6H3.
What are the key properties of 2-(4-tert-butylphenyl)-3-methylbutan-2-amine?
2-(4-tert-butylphenyl)-3-methylbutan-2-amine has a molecular weight of 219.37 g/mol, XLogP of 3.81, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)-3-methylbutan-2-amine is sourced from PubChem (CID 62548190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).