6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine

C14H15ClFN3 — CID 62286054

IUPAC6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine
SMILESCN(Cc1ccc(F)cc1)c1ccc(Cl)c(CN)n1
InChIInChI=1S/C14H15ClFN3/c1-19(9-10-2-4-11(16)5-3-10)14-7-6-12(15)13(8-17)18-14/h2-7H,8-9,17H2,1H3
InChIKeyLEJXFWMROSVATR-UHFFFAOYSA-N
MW279.75 g/mol
LogP2.97
Rot. Bonds4

About 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine

6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine (PubChem CID 62286054) has the molecular formula C14H15ClFN3 and a molecular weight of 279.75 g/mol. Its IUPAC name is 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine
PubChem CID62286054
Molecular FormulaC14H15ClFN3
Molecular Weight279.75 g/mol
Exact Mass279.09
IUPAC Name6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine
SMILESCN(Cc1ccc(F)cc1)c1ccc(Cl)c(CN)n1
InChIInChI=1S/C14H15ClFN3/c1-19(9-10-2-4-11(16)5-3-10)14-7-6-12(15)13(8-17)18-14/h2-7H,8-9,17H2,1H3
InChIKeyLEJXFWMROSVATR-UHFFFAOYSA-N
XLogP2.97
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.75
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine (CID 62286054) is 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine is CN(Cc1ccc(F)cc1)c1ccc(Cl)c(CN)n1.
What is the InChIKey of 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine?
The InChIKey is LEJXFWMROSVATR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClFN3/c1-19(9-10-2-4-11(16)5-3-10)14-7-6-12(15)13(8-17)18-14/h2-7H,8-9,17H2,1H3.
What are the key properties of 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine?
6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine has a molecular weight of 279.75 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 62286054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).