[2-(aminomethyl)-4-fluorophenyl]methanamine

C8H11FN2 — CID 44784876

IUPAC[2-(aminomethyl)-4-fluorophenyl]methanamine
SMILESNCc1ccc(F)cc1CN
InChIInChI=1S/C8H11FN2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3H,4-5,10-11H2
InChIKeyPZAOALVSENBAGU-UHFFFAOYSA-N
MW154.19 g/mol
LogP0.74
Rot. Bonds2

About [2-(aminomethyl)-4-fluorophenyl]methanamine

[2-(aminomethyl)-4-fluorophenyl]methanamine (PubChem CID 44784876) has the molecular formula C8H11FN2 and a molecular weight of 154.19 g/mol. Its IUPAC name is [2-(aminomethyl)-4-fluorophenyl]methanamine.

Molecular Properties

Compound Name[2-(aminomethyl)-4-fluorophenyl]methanamine
PubChem CID44784876
Molecular FormulaC8H11FN2
Molecular Weight154.19 g/mol
Exact Mass154.09
IUPAC Name[2-(aminomethyl)-4-fluorophenyl]methanamine
SMILESNCc1ccc(F)cc1CN
InChIInChI=1S/C8H11FN2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3H,4-5,10-11H2
InChIKeyPZAOALVSENBAGU-UHFFFAOYSA-N
XLogP0.74
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[5-fluoro-2-(methoxymethyl)phenyl]methanamine
CID 63289386
(4-fluoro-2-iodophenyl)methanamine
CID 21069911
[4-fluoro-2-(2-methylpropylsulfonylmethyl)phenyl]methanamine
CID 64764702
[4-fluoro-2-[(4-methylphenyl)sulfanylmethyl]phenyl]methanamine
CID 64764660
[5-fluoro-2-(pyrrolidin-1-ylmethyl)phenyl]methanamine
CID 63288576
[4-fluoro-2-[[(4-fluorophenyl)methyl-methylamino]methyl]phenyl]methanamine
CID 64769510
[4-fluoro-2-[(4-fluorophenyl)sulfinylmethyl]phenyl]methanamine
CID 81328809
[4-fluoro-2-(piperidin-1-ylmethyl)phenyl]methanamine
CID 64768327
[2-(2,2-difluoroethoxymethyl)-4-fluorophenyl]methanamine
CID 82003824
(5-fluoro-2-methoxyphenyl)methanamine
CID 18348829
[2-(benzylsulfanylmethyl)-5-fluorophenyl]methanamine
CID 55172896
2-[[2-(aminomethyl)-4-fluorophenyl]methyl-(2-amino-2-oxoethyl)amino]acetamide
CID 63289211

Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)-4-fluorophenyl]methanamine?
The IUPAC name of [2-(aminomethyl)-4-fluorophenyl]methanamine (CID 44784876) is [2-(aminomethyl)-4-fluorophenyl]methanamine.
What is the SMILES notation for [2-(aminomethyl)-4-fluorophenyl]methanamine?
The canonical SMILES for [2-(aminomethyl)-4-fluorophenyl]methanamine is NCc1ccc(F)cc1CN.
What is the InChIKey of [2-(aminomethyl)-4-fluorophenyl]methanamine?
The InChIKey is PZAOALVSENBAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3H,4-5,10-11H2.
What are the key properties of [2-(aminomethyl)-4-fluorophenyl]methanamine?
[2-(aminomethyl)-4-fluorophenyl]methanamine has a molecular weight of 154.19 g/mol, XLogP of 0.74, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)-4-fluorophenyl]methanamine is sourced from PubChem (CID 44784876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).