6-(3-fluoropropyl)-4-methylpyridin-2-amine

C9H13FN2 — CID 42625617

IUPAC6-(3-fluoropropyl)-4-methylpyridin-2-amine
SMILESCc1cc(N)nc(CCCF)c1
InChIInChI=1S/C9H13FN2/c1-7-5-8(3-2-4-10)12-9(11)6-7/h5-6H,2-4H2,1H3,(H2,11,12)
InChIKeyUWBOFUBWKXYIJF-UHFFFAOYSA-N
MW168.21 g/mol
LogP1.87
Rot. Bonds3

About 6-(3-fluoropropyl)-4-methylpyridin-2-amine

6-(3-fluoropropyl)-4-methylpyridin-2-amine (PubChem CID 42625617) has the molecular formula C9H13FN2 and a molecular weight of 168.21 g/mol. Its IUPAC name is 6-(3-fluoropropyl)-4-methylpyridin-2-amine.

Molecular Properties

Compound Name6-(3-fluoropropyl)-4-methylpyridin-2-amine
PubChem CID42625617
Molecular FormulaC9H13FN2
Molecular Weight168.21 g/mol
Exact Mass168.11
IUPAC Name6-(3-fluoropropyl)-4-methylpyridin-2-amine
SMILESCc1cc(N)nc(CCCF)c1
InChIInChI=1S/C9H13FN2/c1-7-5-8(3-2-4-10)12-9(11)6-7/h5-6H,2-4H2,1H3,(H2,11,12)
InChIKeyUWBOFUBWKXYIJF-UHFFFAOYSA-N
XLogP1.87
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.21
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(3-fluoropropyl)-4-methylpyridin-2-amine?
The IUPAC name of 6-(3-fluoropropyl)-4-methylpyridin-2-amine (CID 42625617) is 6-(3-fluoropropyl)-4-methylpyridin-2-amine.
What is the SMILES notation for 6-(3-fluoropropyl)-4-methylpyridin-2-amine?
The canonical SMILES for 6-(3-fluoropropyl)-4-methylpyridin-2-amine is Cc1cc(N)nc(CCCF)c1.
What is the InChIKey of 6-(3-fluoropropyl)-4-methylpyridin-2-amine?
The InChIKey is UWBOFUBWKXYIJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN2/c1-7-5-8(3-2-4-10)12-9(11)6-7/h5-6H,2-4H2,1H3,(H2,11,12).
What are the key properties of 6-(3-fluoropropyl)-4-methylpyridin-2-amine?
6-(3-fluoropropyl)-4-methylpyridin-2-amine has a molecular weight of 168.21 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluoropropyl)-4-methylpyridin-2-amine is sourced from PubChem (CID 42625617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).