3-(4-cyclopropylcyclohexyl)-2-fluoropyridine

C14H18FN — CID 177327571

IUPAC3-(4-cyclopropylcyclohexyl)-2-fluoropyridine
SMILESFc1ncccc1C1CCC(C2CC2)CC1
InChIInChI=1S/C14H18FN/c15-14-13(2-1-9-16-14)12-7-5-11(6-8-12)10-3-4-10/h1-2,9-12H,3-8H2
InChIKeyBASNIPPRZOIHHZ-UHFFFAOYSA-N
MW219.30 g/mol
LogP3.90
Rot. Bonds2

About 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine

3-(4-cyclopropylcyclohexyl)-2-fluoropyridine (PubChem CID 177327571) has the molecular formula C14H18FN and a molecular weight of 219.30 g/mol. Its IUPAC name is 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine.

Molecular Properties

Compound Name3-(4-cyclopropylcyclohexyl)-2-fluoropyridine
PubChem CID177327571
Molecular FormulaC14H18FN
Molecular Weight219.30 g/mol
Exact Mass219.14
IUPAC Name3-(4-cyclopropylcyclohexyl)-2-fluoropyridine
SMILESFc1ncccc1C1CCC(C2CC2)CC1
InChIInChI=1S/C14H18FN/c15-14-13(2-1-9-16-14)12-7-5-11(6-8-12)10-3-4-10/h1-2,9-12H,3-8H2
InChIKeyBASNIPPRZOIHHZ-UHFFFAOYSA-N
XLogP3.90
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.30
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

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3-[(2S)-azetidin-2-yl]-2-fluoropyridine
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3-[(2S)-aziridin-2-yl]-2-fluoropyridine
CID 55263159
4-(2-fluoro-3-pyridinyl)-1-methylpiperidin-2-one
CID 59327010
(1S)-3-(2-fluoro-3-pyridinyl)-1-methylcyclohexan-1-ol
CID 70888991
2-fluoro-3-(oxolan-2-yl)pyridine
CID 67168066
3-(4-aminocyclohexyl)pyridin-2-amine
CID 83261789
2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride
CID 171196297
(4S)-4-(2-fluoro-3-pyridinyl)imidazolidin-2-one
CID 130916233
8-cyclopropylquinoline
CID 66823369
3-(2,5-dihydrofuran-2-yl)-2-fluoropyridine
CID 67167650

Frequently Asked Questions

What is the IUPAC name of 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine?
The IUPAC name of 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine (CID 177327571) is 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine.
What is the SMILES notation for 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine?
The canonical SMILES for 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine is Fc1ncccc1C1CCC(C2CC2)CC1.
What is the InChIKey of 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine?
The InChIKey is BASNIPPRZOIHHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN/c15-14-13(2-1-9-16-14)12-7-5-11(6-8-12)10-3-4-10/h1-2,9-12H,3-8H2.
What are the key properties of 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine?
3-(4-cyclopropylcyclohexyl)-2-fluoropyridine has a molecular weight of 219.30 g/mol, XLogP of 3.90, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-cyclopropylcyclohexyl)-2-fluoropyridine is sourced from PubChem (CID 177327571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).