1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine

C15H16FNO — CID 81283092

IUPAC1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine
SMILESCNC(c1ccccc1)c1ccc(F)c(OC)c1
InChIInChI=1S/C15H16FNO/c1-17-15(11-6-4-3-5-7-11)12-8-9-13(16)14(10-12)18-2/h3-10,15,17H,1-2H3
InChIKeyMPDWXWNRVZQFTG-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.14
Rot. Bonds4

About 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine

1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine (PubChem CID 81283092) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine.

Molecular Properties

Compound Name1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine
PubChem CID81283092
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine
SMILESCNC(c1ccccc1)c1ccc(F)c(OC)c1
InChIInChI=1S/C15H16FNO/c1-17-15(11-6-4-3-5-7-11)12-8-9-13(16)14(10-12)18-2/h3-10,15,17H,1-2H3
InChIKeyMPDWXWNRVZQFTG-UHFFFAOYSA-N
XLogP3.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluoro-3-methoxyphenyl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 81282943
1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 81283237
1-(3-fluoro-4-methoxyphenyl)-1-(4-fluoro-3-methoxyphenyl)-N-methylmethanamine
CID 81288273
1-(3,4-dimethylphenyl)-1-(4-fluoro-3-methoxyphenyl)-N-methylmethanamine
CID 81283805
1-(4-fluoro-3-methoxyphenyl)-1-(4-fluoro-3-methylphenyl)-N-methylmethanamine
CID 81283311
1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-(3-propylphenyl)methanamine
CID 105050407
1-(3-chloro-4-fluorophenyl)-N-methyl-1-phenylmethanamine
CID 55181591
1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
CID 115854824
1-(5-chloro-2-methoxyphenyl)-1-(4-fluoro-3-methoxyphenyl)-N-methylmethanamine
CID 104545899
1-(2-fluoro-4-methoxyphenyl)-1-(4-fluoro-3-methoxyphenyl)-N-methylmethanamine
CID 81288450
1-(4-chlorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylmethanamine
CID 43481405
1-(2,6-difluorophenyl)-1-(3,4-dimethoxyphenyl)-N-methylmethanamine
CID 43481181

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine?
The IUPAC name of 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine (CID 81283092) is 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine.
What is the SMILES notation for 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine?
The canonical SMILES for 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine is CNC(c1ccccc1)c1ccc(F)c(OC)c1.
What is the InChIKey of 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine?
The InChIKey is MPDWXWNRVZQFTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-17-15(11-6-4-3-5-7-11)12-8-9-13(16)14(10-12)18-2/h3-10,15,17H,1-2H3.
What are the key properties of 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine?
1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine has a molecular weight of 245.30 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-3-methoxyphenyl)-N-methyl-1-phenylmethanamine is sourced from PubChem (CID 81283092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).