5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine

C13H13FN2O — CID 83170169

IUPAC5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine
SMILESCOc1cccc(-c2cnc(N)c(C)c2)c1F
InChIInChI=1S/C13H13FN2O/c1-8-6-9(7-16-13(8)15)10-4-3-5-11(17-2)12(10)14/h3-7H,1-2H3,(H2,15,16)
InChIKeyQVNSDCDMOLYAOX-UHFFFAOYSA-N
MW232.26 g/mol
LogP2.79
Rot. Bonds2

About 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine

5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine (PubChem CID 83170169) has the molecular formula C13H13FN2O and a molecular weight of 232.26 g/mol. Its IUPAC name is 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine.

Molecular Properties

Compound Name5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine
PubChem CID83170169
Molecular FormulaC13H13FN2O
Molecular Weight232.26 g/mol
Exact Mass232.10
IUPAC Name5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine
SMILESCOc1cccc(-c2cnc(N)c(C)c2)c1F
InChIInChI=1S/C13H13FN2O/c1-8-6-9(7-16-13(8)15)10-4-3-5-11(17-2)12(10)14/h3-7H,1-2H3,(H2,15,16)
InChIKeyQVNSDCDMOLYAOX-UHFFFAOYSA-N
XLogP2.79
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Pyrilamine
CID 4992
2,4-Pyrimidinediamine, 5-((3-methoxyphenyl)methyl)-
CID 101067
Thiourea, N-(2-(2-cyano-6-fluoro-3-methoxyphenyl)ethyl)-N'-(5-cyano-2-pyridinyl)-
CID 3001157
Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-(2,6-difluoro-3-methoxyphenyl)ethyl)-
CID 3001149
2-Pyridinamine, 4-(4-methoxyphenyl)-
CID 82397500
2-[(2-Methylaminoethyl)(P-Methoxybenzyl)Amino]Pyridine
CID 153224
N-(4-Methoxybenzyl)pyridin-2-amine
CID 97452
4-(4-Chloranyl-3-methoxy-phenyl)pyridin-2-amine
CID 104877339
[3H]pyrilamine
CID 656400
2-Amino-4-(3-methoxyphenyl)-6-pyridin-3-ylpyridine-3-carbonitrile
CID 938228
5-(3,4-Dimethoxyphenyl)pyrimidin-4-amine
CID 321726
5-(3-Ethoxy-benzyl)-pyrimidine-2,4-diamine
CID 10634047

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine?
The IUPAC name of 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine (CID 83170169) is 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine.
What is the SMILES notation for 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine?
The canonical SMILES for 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine is COc1cccc(-c2cnc(N)c(C)c2)c1F.
What is the InChIKey of 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine?
The InChIKey is QVNSDCDMOLYAOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O/c1-8-6-9(7-16-13(8)15)10-4-3-5-11(17-2)12(10)14/h3-7H,1-2H3,(H2,15,16).
What are the key properties of 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine?
5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine has a molecular weight of 232.26 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoro-3-methoxyphenyl)-3-methylpyridin-2-amine is sourced from PubChem (CID 83170169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).