3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine

C14H15FN2O2 — CID 157017577

IUPAC3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine
SMILESCOc1ccc(-c2cc(OC)c(C)nc2N)cc1F
InChIInChI=1S/C14H15FN2O2/c1-8-13(19-3)7-10(14(16)17-8)9-4-5-12(18-2)11(15)6-9/h4-7H,1-3H3,(H2,16,17)
InChIKeyQHKMKCDDLJNPRC-UHFFFAOYSA-N
MW262.28 g/mol
LogP2.80
Rot. Bonds3

About 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine

3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine (PubChem CID 157017577) has the molecular formula C14H15FN2O2 and a molecular weight of 262.28 g/mol. Its IUPAC name is 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine
PubChem CID157017577
Molecular FormulaC14H15FN2O2
Molecular Weight262.28 g/mol
Exact Mass262.11
IUPAC Name3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine
SMILESCOc1ccc(-c2cc(OC)c(C)nc2N)cc1F
InChIInChI=1S/C14H15FN2O2/c1-8-13(19-3)7-10(14(16)17-8)9-4-5-12(18-2)11(15)6-9/h4-7H,1-3H3,(H2,16,17)
InChIKeyQHKMKCDDLJNPRC-UHFFFAOYSA-N
XLogP2.80
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.28
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine?
The IUPAC name of 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine (CID 157017577) is 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine.
What is the SMILES notation for 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine?
The canonical SMILES for 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine is COc1ccc(-c2cc(OC)c(C)nc2N)cc1F.
What is the InChIKey of 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine?
The InChIKey is QHKMKCDDLJNPRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O2/c1-8-13(19-3)7-10(14(16)17-8)9-4-5-12(18-2)11(15)6-9/h4-7H,1-3H3,(H2,16,17).
What are the key properties of 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine?
3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine has a molecular weight of 262.28 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine is sourced from PubChem (CID 157017577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).