2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine

C17H21NO — CID 55017685

IUPAC2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine
SMILESCC(C)c1ccccc1OC(CN)c1ccccc1
InChIInChI=1S/C17H21NO/c1-13(2)15-10-6-7-11-16(15)19-17(12-18)14-8-4-3-5-9-14/h3-11,13,17H,12,18H2,1-2H3
InChIKeyOBADZUNCZYBIKZ-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.89
Rot. Bonds5

About 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine

2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine (PubChem CID 55017685) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine.

Molecular Properties

Compound Name2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine
PubChem CID55017685
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine
SMILESCC(C)c1ccccc1OC(CN)c1ccccc1
InChIInChI=1S/C17H21NO/c1-13(2)15-10-6-7-11-16(15)19-17(12-18)14-8-4-3-5-9-14/h3-11,13,17H,12,18H2,1-2H3
InChIKeyOBADZUNCZYBIKZ-UHFFFAOYSA-N
XLogP3.89
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine 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-iodophenoxy)-2-phenylethanamine
CID 55017639
2-phenyl-4-(2-propan-2-ylphenoxy)butan-1-amine
CID 82137983
2-phenoxy-2-phenylethanamine;sulfane
CID 174620608
2-phenoxy-2-phenylethanamine chloride
CID 21228850
2-(2-methoxy-4-methylphenoxy)-2-phenylethanamine
CID 55017730
2-(2-chloro-5-methylphenoxy)-2-phenylethanamine
CID 55017590
2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine
CID 64854414
2-(4-bromo-2-propan-2-ylphenoxy)-2-(3-fluorophenyl)ethanamine
CID 115401662
N-butyl-N-[1-(2-propan-2-ylphenoxy)ethyl]aniline
CID 70632939
1-(2-methylpropoxy)-2-propan-2-ylbenzene
CID 58901647
3-amino-2-(2-propan-2-ylphenoxy)butan-1-ol
CID 64898304
2-(4-bromophenyl)-2-(2-methylsulfanylphenoxy)ethanamine
CID 63647284

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine?
The IUPAC name of 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine (CID 55017685) is 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine.
What is the SMILES notation for 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine?
The canonical SMILES for 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine is CC(C)c1ccccc1OC(CN)c1ccccc1.
What is the InChIKey of 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine?
The InChIKey is OBADZUNCZYBIKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-13(2)15-10-6-7-11-16(15)19-17(12-18)14-8-4-3-5-9-14/h3-11,13,17H,12,18H2,1-2H3.
What are the key properties of 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine?
2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine has a molecular weight of 255.36 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine is sourced from PubChem (CID 55017685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).