(2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine

C16H18FNO — CID 62514630

IUPAC(2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine
SMILESCOc1ccc(C(N)c2cc(C)ccc2F)c(C)c1
InChIInChI=1S/C16H18FNO/c1-10-4-7-15(17)14(8-10)16(18)13-6-5-12(19-3)9-11(13)2/h4-9,16H,18H2,1-3H3
InChIKeyUCOXVNFUKWUOTK-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.50
Rot. Bonds3

About (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine

(2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine (PubChem CID 62514630) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine.

Molecular Properties

Compound Name(2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine
PubChem CID62514630
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name(2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine
SMILESCOc1ccc(C(N)c2cc(C)ccc2F)c(C)c1
InChIInChI=1S/C16H18FNO/c1-10-4-7-15(17)14(8-10)16(18)13-6-5-12(19-3)9-11(13)2/h4-9,16H,18H2,1-3H3
InChIKeyUCOXVNFUKWUOTK-UHFFFAOYSA-N
XLogP3.50
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine 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-dimethylphenyl)-(2-fluoro-4-methoxyphenyl)methanamine
CID 43561246
(2-methoxy-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine
CID 62505242
(4,5-dimethoxy-2-methylphenyl)-(2-fluoro-5-methylphenyl)methanamine
CID 62514648
(2-fluoro-5-methylphenyl)-(4-methoxy-2,5-dimethylphenyl)methanamine
CID 105032758
(2,4-dimethoxyphenyl)-(2,4-dimethylphenyl)methanamine
CID 43197259
(2,5-difluoro-4-methylphenyl)-(2-fluoro-4-methoxyphenyl)methanamine
CID 102882947
(2,6-difluoro-4-methoxyphenyl)-(2,4-dimethylphenyl)methanamine
CID 60964479
N-[(2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methyl]ethanamine
CID 62514109
(4-chloro-2-methoxyphenyl)-(2-fluoro-5-methylphenyl)methanamine
CID 115852897
(2,4-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanamine
CID 43198782
(2-fluoro-5-methylphenyl)-(2,3,4-trifluorophenyl)methanamine
CID 115852670
(5-chloro-2-methylphenyl)-(2-fluoro-4-methoxyphenyl)methanamine
CID 82883895

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine?
The IUPAC name of (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine (CID 62514630) is (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine.
What is the SMILES notation for (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine?
The canonical SMILES for (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine is COc1ccc(C(N)c2cc(C)ccc2F)c(C)c1.
What is the InChIKey of (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine?
The InChIKey is UCOXVNFUKWUOTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-10-4-7-15(17)14(8-10)16(18)13-6-5-12(19-3)9-11(13)2/h4-9,16H,18H2,1-3H3.
What are the key properties of (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine?
(2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine has a molecular weight of 259.32 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine is sourced from PubChem (CID 62514630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).