1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine

C17H20ClNO — CID 63326375

IUPAC1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine
SMILESCc1ccc(OCc2ccccc2Cl)c(CC(C)N)c1
InChIInChI=1S/C17H20ClNO/c1-12-7-8-17(15(9-12)10-13(2)19)20-11-14-5-3-4-6-16(14)18/h3-9,13H,10-11,19H2,1-2H3
InChIKeyGZDFZJGGVMURNB-UHFFFAOYSA-N
MW289.81 g/mol
LogP4.12
Rot. Bonds5

About 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine

1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine (PubChem CID 63326375) has the molecular formula C17H20ClNO and a molecular weight of 289.81 g/mol. Its IUPAC name is 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine.

Molecular Properties

Compound Name1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine
PubChem CID63326375
Molecular FormulaC17H20ClNO
Molecular Weight289.81 g/mol
Exact Mass289.12
IUPAC Name1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine
SMILESCc1ccc(OCc2ccccc2Cl)c(CC(C)N)c1
InChIInChI=1S/C17H20ClNO/c1-12-7-8-17(15(9-12)10-13(2)19)20-11-14-5-3-4-6-16(14)18/h3-9,13H,10-11,19H2,1-2H3
InChIKeyGZDFZJGGVMURNB-UHFFFAOYSA-N
XLogP4.12
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.81
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine 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

1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326290
2-[(2-chlorophenyl)methoxy]-5-methylaniline
CID 39350494
1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63325862
1-[3-bromo-4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-2-amine
CID 106868969
1-(5-methyl-2-prop-2-ynoxyphenyl)propan-2-amine
CID 63326075
1-[2-(2-chloro-5-methylphenoxy)phenyl]propan-2-amine
CID 63803481
1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine
CID 65364966
4-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]butanoic acid
CID 82051907
(1S)-1-[2-[(2-chloro-4-methylphenyl)methoxy]phenyl]ethanamine
CID 106861855
1-[5-methyl-2-(3-methylbutoxy)phenyl]propan-2-amine
CID 55200535
1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63985125
2-[2-(2-aminopropyl)-4-methylphenoxy]acetonitrile
CID 63326461

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine?
The IUPAC name of 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine (CID 63326375) is 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine.
What is the SMILES notation for 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine?
The canonical SMILES for 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine is Cc1ccc(OCc2ccccc2Cl)c(CC(C)N)c1.
What is the InChIKey of 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine?
The InChIKey is GZDFZJGGVMURNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClNO/c1-12-7-8-17(15(9-12)10-13(2)19)20-11-14-5-3-4-6-16(14)18/h3-9,13H,10-11,19H2,1-2H3.
What are the key properties of 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine?
1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine has a molecular weight of 289.81 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine is sourced from PubChem (CID 63326375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).