2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol

C13H21NO — CID 106508028

IUPAC2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol
SMILESCC(C)CC(CN)(CO)c1ccccc1
InChIInChI=1S/C13H21NO/c1-11(2)8-13(9-14,10-15)12-6-4-3-5-7-12/h3-7,11,15H,8-10,14H2,1-2H3
InChIKeyZORNZKGGAYAZIP-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.92
Rot. Bonds5

About 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol

2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol (PubChem CID 106508028) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol.

Molecular Properties

Compound Name2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol
PubChem CID106508028
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol
SMILESCC(C)CC(CN)(CO)c1ccccc1
InChIInChI=1S/C13H21NO/c1-11(2)8-13(9-14,10-15)12-6-4-3-5-7-12/h3-7,11,15H,8-10,14H2,1-2H3
InChIKeyZORNZKGGAYAZIP-UHFFFAOYSA-N
XLogP1.92
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol 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-(4-methylpentyl)-2-phenylpropane-1,3-diol
CID 83168289
2-(2-methylpentyl)-2-phenylpropane-1,3-diol
CID 79449866
2-(aminomethyl)-4-ethoxy-2-phenylbutan-1-ol
CID 106508031
2-(aminomethyl)-4-methoxy-2-(4-methylphenyl)pentan-1-ol
CID 106508650
4-amino-2-ethyl-2-phenylbutan-1-ol;ethane
CID 143493864
2-amino-1,1-diphenylethanol;2-methylpropane
CID 143904354
5-amino-4,4-diphenylpentan-2-ol
CID 24973034
2-(aminomethyl)-3-(3-fluorophenyl)-2-phenylpropan-1-ol
CID 106508050
2-(aminomethyl)-2-(4-fluorophenyl)-6-methylheptan-1-ol
CID 106505955
2-amino-3-methyl-2-phenylbutan-1-ol
CID 61056437
1-amino-4,6-dimethyl-2-phenylheptan-2-ol
CID 114200484
2-ethyl-4-(2-methylpropoxy)-2-phenylbutan-1-amine
CID 106456783

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol?
The IUPAC name of 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol (CID 106508028) is 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol.
What is the SMILES notation for 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol?
The canonical SMILES for 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol is CC(C)CC(CN)(CO)c1ccccc1.
What is the InChIKey of 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol?
The InChIKey is ZORNZKGGAYAZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-11(2)8-13(9-14,10-15)12-6-4-3-5-7-12/h3-7,11,15H,8-10,14H2,1-2H3.
What are the key properties of 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol?
2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol has a molecular weight of 207.32 g/mol, XLogP of 1.92, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-4-methyl-2-phenylpentan-1-ol is sourced from PubChem (CID 106508028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).