3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine

C14H16FN3 — CID 81246480

IUPAC3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
SMILESCN(Cc1ccc(F)cc1)c1ccncc1CN
InChIInChI=1S/C14H16FN3/c1-18(10-11-2-4-13(15)5-3-11)14-6-7-17-9-12(14)8-16/h2-7,9H,8,10,16H2,1H3
InChIKeyORYMITQEAZALGQ-UHFFFAOYSA-N
MW245.30 g/mol
LogP2.32
Rot. Bonds4

About 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine

3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine (PubChem CID 81246480) has the molecular formula C14H16FN3 and a molecular weight of 245.30 g/mol. Its IUPAC name is 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
PubChem CID81246480
Molecular FormulaC14H16FN3
Molecular Weight245.30 g/mol
Exact Mass245.13
IUPAC Name3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
SMILESCN(Cc1ccc(F)cc1)c1ccncc1CN
InChIInChI=1S/C14H16FN3/c1-18(10-11-2-4-13(15)5-3-11)14-6-7-17-9-12(14)8-16/h2-7,9H,8,10,16H2,1H3
InChIKeyORYMITQEAZALGQ-UHFFFAOYSA-N
XLogP2.32
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethylaminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
CID 81246247
3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine
CID 81246098
3-(aminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyridin-4-amine
CID 81246090
6-N-[(4-fluorophenyl)methyl]-6-N-methylisoquinoline-5,6-diamine
CID 106947676
3-(aminomethyl)-N-(2,2-dimethylpropyl)-N-methylpyridin-4-amine
CID 81246543
2-(aminomethyl)-N-[(4-chlorophenyl)methyl]-4-fluoro-N-methylaniline
CID 61414753
3-(aminomethyl)-N-methyl-N-pentylpyridin-4-amine
CID 81248532
4-(aminomethyl)-3-bromo-2-fluoro-N-methyl-N-(pyridin-4-ylmethyl)aniline
CID 107532176
5-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrimidin-2-amine
CID 113388103
6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine
CID 66451652
3-(aminomethyl)-5-fluoro-N-methyl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 114035262
3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine
CID 81249725

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine?
The IUPAC name of 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine (CID 81246480) is 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine.
What is the SMILES notation for 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine?
The canonical SMILES for 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine is CN(Cc1ccc(F)cc1)c1ccncc1CN.
What is the InChIKey of 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine?
The InChIKey is ORYMITQEAZALGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3/c1-18(10-11-2-4-13(15)5-3-11)14-6-7-17-9-12(14)8-16/h2-7,9H,8,10,16H2,1H3.
What are the key properties of 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine?
3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine has a molecular weight of 245.30 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine is sourced from PubChem (CID 81246480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).