5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine

C14H15FN2O — CID 50976565

IUPAC5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine
SMILESCC(C)Oc1cccc(F)c1-c1ccc(N)nc1
InChIInChI=1S/C14H15FN2O/c1-9(2)18-12-5-3-4-11(15)14(12)10-6-7-13(16)17-8-10/h3-9H,1-2H3,(H2,16,17)
InChIKeyHMBOWSDKQVLNIW-UHFFFAOYSA-N
MW246.28 g/mol
LogP3.26
Rot. Bonds3

About 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine

5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine (PubChem CID 50976565) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine
PubChem CID50976565
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine
SMILESCC(C)Oc1cccc(F)c1-c1ccc(N)nc1
InChIInChI=1S/C14H15FN2O/c1-9(2)18-12-5-3-4-11(15)14(12)10-6-7-13(16)17-8-10/h3-9H,1-2H3,(H2,16,17)
InChIKeyHMBOWSDKQVLNIW-UHFFFAOYSA-N
XLogP3.26
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 ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine?
The IUPAC name of 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine (CID 50976565) is 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine.
What is the SMILES notation for 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine?
The canonical SMILES for 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine is CC(C)Oc1cccc(F)c1-c1ccc(N)nc1.
What is the InChIKey of 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine?
The InChIKey is HMBOWSDKQVLNIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-9(2)18-12-5-3-4-11(15)14(12)10-6-7-13(16)17-8-10/h3-9H,1-2H3,(H2,16,17).
What are the key properties of 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine?
5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine has a molecular weight of 246.28 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoro-6-propan-2-yloxyphenyl)pyridin-2-amine is sourced from PubChem (CID 50976565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).