[4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine

C14H14FNO — CID 61034326

IUPAC[4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine
SMILESCOc1ccc(-c2ccc(CN)cc2)c(F)c1
InChIInChI=1S/C14H14FNO/c1-17-12-6-7-13(14(15)8-12)11-4-2-10(9-16)3-5-11/h2-8H,9,16H2,1H3
InChIKeyXTLJSFZJDCWDNC-UHFFFAOYSA-N
MW231.27 g/mol
LogP2.96
Rot. Bonds3

About [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine

[4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine (PubChem CID 61034326) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine.

Molecular Properties

Compound Name[4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine
PubChem CID61034326
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name[4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine
SMILESCOc1ccc(-c2ccc(CN)cc2)c(F)c1
InChIInChI=1S/C14H14FNO/c1-17-12-6-7-13(14(15)8-12)11-4-2-10(9-16)3-5-11/h2-8H,9,16H2,1H3
InChIKeyXTLJSFZJDCWDNC-UHFFFAOYSA-N
XLogP2.96
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-fluoro-4-(6-methoxynaphthalen-2-yl)phenyl]methanamine
CID 81441338
2-fluoro-1-(4-fluorophenyl)-4-methoxybenzene
CID 46312221
1-[4-(2-fluoro-4-methoxyphenyl)phenyl]propan-2-one
CID 82541027
4-ethyl-2-fluoro-1-(4-methoxyphenyl)benzene
CID 146522341
[4-(3,4-dimethoxyphenyl)-3-fluorophenyl]methanamine
CID 81446939
2-fluoro-4-[2-(4-methoxyphenyl)ethyl]-1-(4-propylphenyl)benzene
CID 19906916
[5-(2-fluoro-4-methoxyphenyl)-2-phenylmethoxyphenyl]methanamine
CID 172650029
[4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride
CID 71432523
[3-(2,6-difluoro-4-methoxyphenyl)-4-fluorophenyl]methanamine
CID 54910780
[3-(2-fluoro-4-methoxyphenyl)furan-2-yl]methanamine
CID 106887847
[3-[(2-fluoro-4-methoxyphenyl)methoxy]-4-methoxyphenyl]methanamine
CID 102876040
5-(2-fluoro-4-methoxyphenyl)-2-methoxyphenol
CID 53220882

Frequently Asked Questions

What is the IUPAC name of [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine?
The IUPAC name of [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine (CID 61034326) is [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine.
What is the SMILES notation for [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine?
The canonical SMILES for [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine is COc1ccc(-c2ccc(CN)cc2)c(F)c1.
What is the InChIKey of [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine?
The InChIKey is XTLJSFZJDCWDNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c1-17-12-6-7-13(14(15)8-12)11-4-2-10(9-16)3-5-11/h2-8H,9,16H2,1H3.
What are the key properties of [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine?
[4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine has a molecular weight of 231.27 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-fluoro-4-methoxyphenyl)phenyl]methanamine is sourced from PubChem (CID 61034326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).