[3-(fluoromethyl)phenyl]methanamine

C8H10FN — CID 58789244

IUPAC[3-(fluoromethyl)phenyl]methanamine
SMILESNCc1cccc(CF)c1
InChIInChI=1S/C8H10FN/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5-6,10H2
InChIKeyFVBKLSHJWAHHPF-UHFFFAOYSA-N
MW139.17 g/mol
LogP1.61
Rot. Bonds2

About [3-(fluoromethyl)phenyl]methanamine

[3-(fluoromethyl)phenyl]methanamine (PubChem CID 58789244) has the molecular formula C8H10FN and a molecular weight of 139.17 g/mol. Its IUPAC name is [3-(fluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(fluoromethyl)phenyl]methanamine
PubChem CID58789244
Molecular FormulaC8H10FN
Molecular Weight139.17 g/mol
Exact Mass139.08
IUPAC Name[3-(fluoromethyl)phenyl]methanamine
SMILESNCc1cccc(CF)c1
InChIInChI=1S/C8H10FN/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5-6,10H2
InChIKeyFVBKLSHJWAHHPF-UHFFFAOYSA-N
XLogP1.61
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.17
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,3-bis(fluoromethyl)benzene
CID 23234185
[3-(aminomethyl)phenyl]methanamine;azane
CID 175725248
[3-(aminomethyl)phenyl]methanamine;boric acid
CID 175765748
[3-(aminomethyl)phenyl]methanamine;ethane;molecular hydrogen
CID 145400663
difluoromethane;phenylmethanamine
CID 156875485
2-[3-(aminomethyl)phenyl]ethanamine
CID 67482147
[3-(bromomethyl)phenyl]methanamine
CID 67540206
[3-(aminomethyl)phenyl]methanamine;thiocyanic acid
CID 175054435
phenylmethanamine
CID 19864074
3-(aminomethyl)aniline;dihydrochloride
CID 23346995
[3-(methoxymethyl)phenyl]methanamine
CID 16787292
[3-(methylsulfanylmethyl)phenyl]methanamine
CID 59652232

Frequently Asked Questions

What is the IUPAC name of [3-(fluoromethyl)phenyl]methanamine?
The IUPAC name of [3-(fluoromethyl)phenyl]methanamine (CID 58789244) is [3-(fluoromethyl)phenyl]methanamine.
What is the SMILES notation for [3-(fluoromethyl)phenyl]methanamine?
The canonical SMILES for [3-(fluoromethyl)phenyl]methanamine is NCc1cccc(CF)c1.
What is the InChIKey of [3-(fluoromethyl)phenyl]methanamine?
The InChIKey is FVBKLSHJWAHHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5-6,10H2.
What are the key properties of [3-(fluoromethyl)phenyl]methanamine?
[3-(fluoromethyl)phenyl]methanamine has a molecular weight of 139.17 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(fluoromethyl)phenyl]methanamine is sourced from PubChem (CID 58789244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).