3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine

C12H17FN2 — CID 90352576

IUPAC3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine
SMILESCCc1cccnc1N1CCC(F)CC1
InChIInChI=1S/C12H17FN2/c1-2-10-4-3-7-14-12(10)15-8-5-11(13)6-9-15/h3-4,7,11H,2,5-6,8-9H2,1H3
InChIKeyKERBDASJKWAHQW-UHFFFAOYSA-N
MW208.28 g/mol
LogP2.58
Rot. Bonds2

About 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine

3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine (PubChem CID 90352576) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine.

Molecular Properties

Compound Name3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine
PubChem CID90352576
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC Name3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine
SMILESCCc1cccnc1N1CCC(F)CC1
InChIInChI=1S/C12H17FN2/c1-2-10-4-3-7-14-12(10)15-8-5-11(13)6-9-15/h3-4,7,11H,2,5-6,8-9H2,1H3
InChIKeyKERBDASJKWAHQW-UHFFFAOYSA-N
XLogP2.58
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 5587
Mirtazapine
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2-Amino-4-methylpyridine
CID 1533
Tripelennamine Hydrochloride
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Chloropyramine
CID 25295
2-Amino-3-methylpyridine
CID 15347
2-Amino-5-methylpyridine
CID 15348
2-(Benzylamino)pyridine
CID 23362
2,2'-Dipyridylamine
CID 14547
1-(2-Pyridyl)piperazine
CID 94459
2-Dimethylaminopyridine
CID 21885
2-Amino-5-(trifluoromethyl)pyridine
CID 735862

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine?
The IUPAC name of 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine (CID 90352576) is 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine.
What is the SMILES notation for 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine?
The canonical SMILES for 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine is CCc1cccnc1N1CCC(F)CC1.
What is the InChIKey of 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine?
The InChIKey is KERBDASJKWAHQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2/c1-2-10-4-3-7-14-12(10)15-8-5-11(13)6-9-15/h3-4,7,11H,2,5-6,8-9H2,1H3.
What are the key properties of 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine?
3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine has a molecular weight of 208.28 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-(4-fluoropiperidin-1-yl)pyridine is sourced from PubChem (CID 90352576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).