(3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine

C15H16FNO — CID 60819510

IUPAC(3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine
SMILESCOc1cccc(C(N)c2ccc(C)c(F)c2)c1
InChIInChI=1S/C15H16FNO/c1-10-6-7-12(9-14(10)16)15(17)11-4-3-5-13(8-11)18-2/h3-9,15H,17H2,1-2H3
InChIKeyAILUFKVIKPLRGV-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.19
Rot. Bonds3

About (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine

(3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine (PubChem CID 60819510) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine.

Molecular Properties

Compound Name(3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine
PubChem CID60819510
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name(3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine
SMILESCOc1cccc(C(N)c2ccc(C)c(F)c2)c1
InChIInChI=1S/C15H16FNO/c1-10-6-7-12(9-14(10)16)15(17)11-4-3-5-13(8-11)18-2/h3-9,15H,17H2,1-2H3
InChIKeyAILUFKVIKPLRGV-UHFFFAOYSA-N
XLogP3.19
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-N-[1-(3-fluoro-4-methylphenyl)ethyl]-1-(3-methoxyphenyl)ethanamine
CID 81382610
(2-fluorophenyl)-(3-methoxyphenyl)methanamine
CID 62501632
1-(3-fluoro-4-methylphenyl)-2-(3-methoxyphenyl)ethanamine
CID 61078688
4-[amino-(3-methoxyphenyl)methyl]aniline
CID 116936827
(4-iodophenyl)-(3-methoxyphenyl)methanamine
CID 115785175
(3-fluoro-4-methylphenyl)-pyridin-3-ylmethanamine
CID 60923509
(3-methoxyphenyl)-(2,3,5,6-tetramethylphenyl)methanamine
CID 43197723
(3-bromophenyl)-(3-methoxyphenyl)methanamine
CID 59671726
(4-chloro-2-methylphenyl)-(3-methoxyphenyl)methanamine
CID 114028288
(2-bromo-3-fluorophenyl)-(3-methoxyphenyl)methanamine
CID 115785913
4-[1-chloro-2-(3-methoxyphenyl)ethyl]-2-fluoro-1-methylbenzene
CID 63543522
(3,4-difluorophenyl)-(3-propoxyphenyl)methanamine
CID 62920523

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine?
The IUPAC name of (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine (CID 60819510) is (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine.
What is the SMILES notation for (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine?
The canonical SMILES for (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine is COc1cccc(C(N)c2ccc(C)c(F)c2)c1.
What is the InChIKey of (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine?
The InChIKey is AILUFKVIKPLRGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-10-6-7-12(9-14(10)16)15(17)11-4-3-5-13(8-11)18-2/h3-9,15H,17H2,1-2H3.
What are the key properties of (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine?
(3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine has a molecular weight of 245.30 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine is sourced from PubChem (CID 60819510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).