3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine

C10H11FN2 — CID 130506741

IUPAC3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine
SMILESFc1cnccc1C1=CCCNC1
InChIInChI=1S/C10H11FN2/c11-10-7-13-5-3-9(10)8-2-1-4-12-6-8/h2-3,5,7,12H,1,4,6H2
InChIKeyOHHSQWLWTCUKHK-UHFFFAOYSA-N
MW178.21 g/mol
LogP1.60
Rot. Bonds1

About 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine

3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine (PubChem CID 130506741) has the molecular formula C10H11FN2 and a molecular weight of 178.21 g/mol. Its IUPAC name is 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine.

Molecular Properties

Compound Name3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine
PubChem CID130506741
Molecular FormulaC10H11FN2
Molecular Weight178.21 g/mol
Exact Mass178.09
IUPAC Name3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine
SMILESFc1cnccc1C1=CCCNC1
InChIInChI=1S/C10H11FN2/c11-10-7-13-5-3-9(10)8-2-1-4-12-6-8/h2-3,5,7,12H,1,4,6H2
InChIKeyOHHSQWLWTCUKHK-UHFFFAOYSA-N
XLogP1.60
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.21
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(3-fluoro-4-pyridinyl)-1,2,3,4-tetrahydroisoquinoline
CID 56861224
5-(2-fluoro-5-methylphenyl)-1,2,3,6-tetrahydropyridine
CID 130506647
3-(3-fluoro-4-pyridinyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
CID 64955329
5-(3-bromo-2-fluorophenyl)-1,2,3,6-tetrahydropyridine
CID 130506757
3-fluoro-4-(4-fluorophenyl)pyridine
CID 46312739
5-(7-fluoro-1-benzothiophen-3-yl)-1,2,3,6-tetrahydropyridine
CID 176569311
4-methyl-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-pyrrolo[2,3-b]pyridine
CID 168941722
4-fluoro-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole
CID 168941468
5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole;hydrochloride
CID 154803645
5-chloro-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole
CID 168941463
4-(2,3-difluorophenyl)-3-fluoropyridine
CID 118801718
5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine
CID 176586744

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine?
The IUPAC name of 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine (CID 130506741) is 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine.
What is the SMILES notation for 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine?
The canonical SMILES for 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine is Fc1cnccc1C1=CCCNC1.
What is the InChIKey of 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine?
The InChIKey is OHHSQWLWTCUKHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2/c11-10-7-13-5-3-9(10)8-2-1-4-12-6-8/h2-3,5,7,12H,1,4,6H2.
What are the key properties of 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine?
3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine has a molecular weight of 178.21 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)pyridine is sourced from PubChem (CID 130506741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).