2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine

C14H15FN2O — CID 103183013

IUPAC2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine
SMILESCc1cnc(COc2ccc(F)cc2)c(C)c1N
InChIInChI=1S/C14H15FN2O/c1-9-7-17-13(10(2)14(9)16)8-18-12-5-3-11(15)4-6-12/h3-7H,8H2,1-2H3,(H2,16,17)
InChIKeyIRZMNGZIVNCONK-UHFFFAOYSA-N
MW246.28 g/mol
LogP3.00
Rot. Bonds3

About 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine

2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine (PubChem CID 103183013) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine.

Molecular Properties

Compound Name2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine
PubChem CID103183013
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine
SMILESCc1cnc(COc2ccc(F)cc2)c(C)c1N
InChIInChI=1S/C14H15FN2O/c1-9-7-17-13(10(2)14(9)16)8-18-12-5-3-11(15)4-6-12/h3-7H,8H2,1-2H3,(H2,16,17)
InChIKeyIRZMNGZIVNCONK-UHFFFAOYSA-N
XLogP3.00
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-methoxyphenoxy)methyl]-3,5-dimethylpyridin-4-amine
CID 103183021
3,5-dimethyl-2-(naphthalen-2-yloxymethyl)pyridin-4-amine
CID 103183022
2-(methoxymethyl)-3,5-dimethylpyridin-4-amine
CID 103182974
3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine
CID 103183024
3,5-dimethyl-2-(2-methylpropoxymethyl)pyridin-4-amine
CID 103183038
3,5-dimethyl-2-(1-phenylethoxymethyl)pyridin-4-amine
CID 103183068
3,5-dimethyl-2-(pentan-2-yloxymethyl)pyridin-4-amine
CID 103183318
2-[(4-methoxy-N-methylanilino)methyl]-3,5-dimethylpyridin-4-amine
CID 103182279
5-[(4-fluorophenoxy)methyl]-2-methylaniline
CID 117221912
5-[(4-fluorophenoxy)methyl]-1,3-thiazol-2-amine
CID 79775144
2-[[methoxy(methyl)amino]methyl]-3,5-dimethylpyridin-4-amine
CID 103182114
2-(2-cyclobutylethoxymethyl)-3,5-dimethylpyridin-4-amine
CID 114157294

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine?
The IUPAC name of 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine (CID 103183013) is 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine.
What is the SMILES notation for 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine?
The canonical SMILES for 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine is Cc1cnc(COc2ccc(F)cc2)c(C)c1N.
What is the InChIKey of 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine?
The InChIKey is IRZMNGZIVNCONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-9-7-17-13(10(2)14(9)16)8-18-12-5-3-11(15)4-6-12/h3-7H,8H2,1-2H3,(H2,16,17).
What are the key properties of 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine?
2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine has a molecular weight of 246.28 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine is sourced from PubChem (CID 103183013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).