2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol

C17H21NO — CID 150452030

IUPAC2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol
SMILESCC(C)(Cc1ccccc1O)c1ccccc1CN
InChIInChI=1S/C17H21NO/c1-17(2,11-13-7-4-6-10-16(13)19)15-9-5-3-8-14(15)12-18/h3-10,19H,11-12,18H2,1-2H3
InChIKeyHNZUOPYRTIBRFF-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.37
Rot. Bonds4

About 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol

2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol (PubChem CID 150452030) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol.

Molecular Properties

Compound Name2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol
PubChem CID150452030
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol
SMILESCC(C)(Cc1ccccc1O)c1ccccc1CN
InChIInChI=1S/C17H21NO/c1-17(2,11-13-7-4-6-10-16(13)19)15-9-5-3-8-14(15)12-18/h3-10,19H,11-12,18H2,1-2H3
InChIKeyHNZUOPYRTIBRFF-UHFFFAOYSA-N
XLogP3.37
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol 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-(2-amino-2-methylpropyl)phenol
CID 22723438
2-(aminomethyl)phenol;methane
CID 158060419
2-[2-methyl-2-(2,3,4-tripropylphenyl)propyl]phenol
CID 67225679
2-(2-aminooxy-2-methylpropyl)phenol
CID 117104866
2-amino-2-[2-(aminomethyl)phenyl]propanoic acid
CID 18975915
2-(3-hydroxy-2,2-dimethylpropyl)phenol
CID 135339227
2-[[2-(aminomethyl)phenyl]methyl]phenol
CID 174458594
2,3,4-tris[2-(2-decylphenyl)-2-methylpropyl]phenol
CID 87315586
2,3,4-tris[2-methyl-2-(2-octylphenyl)propyl]phenol
CID 67224653
[2-(2-fluoro-2-methylpropyl)phenyl]methanamine
CID 84658124
2-(4-amino-2-methylpentan-2-yl)phenol
CID 143655608
2-[[(1-amino-2-methylpropan-2-yl)amino]methyl]phenol
CID 174179021

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol?
The IUPAC name of 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol (CID 150452030) is 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol.
What is the SMILES notation for 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol?
The canonical SMILES for 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol is CC(C)(Cc1ccccc1O)c1ccccc1CN.
What is the InChIKey of 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol?
The InChIKey is HNZUOPYRTIBRFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-17(2,11-13-7-4-6-10-16(13)19)15-9-5-3-8-14(15)12-18/h3-10,19H,11-12,18H2,1-2H3.
What are the key properties of 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol?
2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol has a molecular weight of 255.36 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(aminomethyl)phenyl]-2-methylpropyl]phenol is sourced from PubChem (CID 150452030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).