5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine

C11H16FN3O — CID 97165134

IUPAC5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine
SMILESFc1cnc(OCC[C@H]2CCCNC2)nc1
InChIInChI=1S/C11H16FN3O/c12-10-7-14-11(15-8-10)16-5-3-9-2-1-4-13-6-9/h7-9,13H,1-6H2/t9-/m1/s1
InChIKeyUJCKOAGTXUJZLP-SECBINFHSA-N
MW225.27 g/mol
LogP1.38
Rot. Bonds4

About 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine

5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine (PubChem CID 97165134) has the molecular formula C11H16FN3O and a molecular weight of 225.27 g/mol. Its IUPAC name is 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine.

Molecular Properties

Compound Name5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine
PubChem CID97165134
Molecular FormulaC11H16FN3O
Molecular Weight225.27 g/mol
Exact Mass225.13
IUPAC Name5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine
SMILESFc1cnc(OCC[C@H]2CCCNC2)nc1
InChIInChI=1S/C11H16FN3O/c12-10-7-14-11(15-8-10)16-5-3-9-2-1-4-13-6-9/h7-9,13H,1-6H2/t9-/m1/s1
InChIKeyUJCKOAGTXUJZLP-SECBINFHSA-N
XLogP1.38
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-methoxy-2-(2-piperidin-3-ylethoxy)pyrimidine
CID 106999595
3-[2-(2-bromo-4-fluorophenoxy)ethyl]piperidine
CID 56830445
(3R)-3-(2-phenoxyethyl)piperidine
CID 26192392
3-(2-piperidin-3-ylethoxy)pyridine;hydrochloride
CID 56830400
3-[2-(2-chloro-4-fluorophenoxy)ethyl]piperidine;hydrochloride
CID 56830076
(3R)-3-[2-(4-iodophenoxy)ethyl]piperidine
CID 86321285
2-[2-[(3R)-piperidin-3-yl]ethoxy]pyridine
CID 94409716
2-methyl-3-[2-[(3R)-piperidin-3-yl]ethoxy]pyrazine
CID 97163244
3-chloro-2-[2-[(3R)-piperidin-3-yl]ethoxy]-5-(trifluoromethyl)pyridine
CID 94409728
3-chloro-2-(2-piperidin-3-ylethoxy)-5-(trifluoromethyl)pyridine
CID 62358361
3-[2-(4-methylphenoxy)ethyl]piperidine
CID 45075559
5-bromo-3-chloro-2-(2-piperidin-3-ylethoxy)pyridine
CID 103583976

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine?
The IUPAC name of 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine (CID 97165134) is 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine.
What is the SMILES notation for 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine?
The canonical SMILES for 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine is Fc1cnc(OCC[C@H]2CCCNC2)nc1.
What is the InChIKey of 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine?
The InChIKey is UJCKOAGTXUJZLP-SECBINFHSA-N. The full InChI is InChI=1S/C11H16FN3O/c12-10-7-14-11(15-8-10)16-5-3-9-2-1-4-13-6-9/h7-9,13H,1-6H2/t9-/m1/s1.
What are the key properties of 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine?
5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine has a molecular weight of 225.27 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-[2-[(3R)-piperidin-3-yl]ethoxy]pyrimidine is sourced from PubChem (CID 97165134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).