1-(2-tert-butylphenyl)-2-methylpropan-2-amine

C14H23N — CID 84778784

IUPAC1-(2-tert-butylphenyl)-2-methylpropan-2-amine
SMILESCC(C)(N)Cc1ccccc1C(C)(C)C
InChIInChI=1S/C14H23N/c1-13(2,3)12-9-7-6-8-11(12)10-14(4,5)15/h6-9H,10,15H2,1-5H3
InChIKeyHTEHAFWFQAVCMC-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.26
Rot. Bonds2

About 1-(2-tert-butylphenyl)-2-methylpropan-2-amine

1-(2-tert-butylphenyl)-2-methylpropan-2-amine (PubChem CID 84778784) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 1-(2-tert-butylphenyl)-2-methylpropan-2-amine.

Molecular Properties

Compound Name1-(2-tert-butylphenyl)-2-methylpropan-2-amine
PubChem CID84778784
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name1-(2-tert-butylphenyl)-2-methylpropan-2-amine
SMILESCC(C)(N)Cc1ccccc1C(C)(C)C
InChIInChI=1S/C14H23N/c1-13(2,3)12-9-7-6-8-11(12)10-14(4,5)15/h6-9H,10,15H2,1-5H3
InChIKeyHTEHAFWFQAVCMC-UHFFFAOYSA-N
XLogP3.26
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-1-[2-(trifluoromethyl)phenyl]propan-2-amine
CID 86277095
2-(2-amino-2-methylpropyl)phenol
CID 22723438
1-(2-fluorophenyl)-2-methylpropan-2-amine;hydrochloride
CID 70701058
1-tert-butyl-2-ethylbenzene;hydrogen peroxide
CID 88799251
3-(2-tert-butylphenyl)propan-1-amine
CID 84772141
1-(2-tert-butylphenyl)-N-iodomethanamine
CID 166969969
1-(2-tert-butylphenyl)-N,N-dimethylmethanamine
CID 21304895
1-tert-butyl-2-tert-butylsulfanylbenzene;1-tert-butyl-2-(2,2-dimethylpropyl)benzene
CID 160876364
2-(2-amino-2-methylpropyl)benzoic acid
CID 175240257
CID 175472927
CID 175472927
bis[2-(2-tert-butylphenyl)ethyl] carbonate
CID 67162129
1-[2-(2-amino-2-methylpropyl)phenyl]cyclopropan-1-ol
CID 117111971

Frequently Asked Questions

What is the IUPAC name of 1-(2-tert-butylphenyl)-2-methylpropan-2-amine?
The IUPAC name of 1-(2-tert-butylphenyl)-2-methylpropan-2-amine (CID 84778784) is 1-(2-tert-butylphenyl)-2-methylpropan-2-amine.
What is the SMILES notation for 1-(2-tert-butylphenyl)-2-methylpropan-2-amine?
The canonical SMILES for 1-(2-tert-butylphenyl)-2-methylpropan-2-amine is CC(C)(N)Cc1ccccc1C(C)(C)C.
What is the InChIKey of 1-(2-tert-butylphenyl)-2-methylpropan-2-amine?
The InChIKey is HTEHAFWFQAVCMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-13(2,3)12-9-7-6-8-11(12)10-14(4,5)15/h6-9H,10,15H2,1-5H3.
What are the key properties of 1-(2-tert-butylphenyl)-2-methylpropan-2-amine?
1-(2-tert-butylphenyl)-2-methylpropan-2-amine has a molecular weight of 205.34 g/mol, XLogP of 3.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-tert-butylphenyl)-2-methylpropan-2-amine is sourced from PubChem (CID 84778784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).