4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine

C18H15FN4O — CID 118205364

IUPAC4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESFc1ncc(-c2cc(OCc3ccccn3)nc3c2CCC3)cn1
InChIInChI=1S/C18H15FN4O/c19-18-21-9-12(10-22-18)15-8-17(23-16-6-3-5-14(15)16)24-11-13-4-1-2-7-20-13/h1-2,4,7-10H,3,5-6,11H2
InChIKeyAZTFJMYGDHHRCI-UHFFFAOYSA-N
MW322.34 g/mol
LogP3.14
Rot. Bonds4

About 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine

4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine (PubChem CID 118205364) has the molecular formula C18H15FN4O and a molecular weight of 322.34 g/mol. Its IUPAC name is 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine.

Molecular Properties

Compound Name4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine
PubChem CID118205364
Molecular FormulaC18H15FN4O
Molecular Weight322.34 g/mol
Exact Mass322.12
IUPAC Name4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESFc1ncc(-c2cc(OCc3ccccn3)nc3c2CCC3)cn1
InChIInChI=1S/C18H15FN4O/c19-18-21-9-12(10-22-18)15-8-17(23-16-6-3-5-14(15)16)24-11-13-4-1-2-7-20-13/h1-2,4,7-10H,3,5-6,11H2
InChIKeyAZTFJMYGDHHRCI-UHFFFAOYSA-N
XLogP3.14
TPSA60.79 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.34
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine with MolForge

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Related Compounds

5-[2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]pyrimidine-2-carbonitrile;hydrochloride
CID 118205309
bis(2-(pyridin-2-ylmethoxy)-4-pyrimidin-5-yl-5,6,7,8-tetrahydroquinoline);hydrochloride
CID 162242010
4-(2-fluoro-5-methyl-3-pyridinyl)-2-(pyridin-2-ylmethoxy)-5,6,7,8-tetrahydroquinoline
CID 118205297
4-(2-methyl-3-pyridinyl)-2-(pyridin-2-ylmethoxy)-5,6,7,8-tetrahydroquinoline
CID 118205251
4-(2-methyl-3-pyridinyl)-2-(pyridin-2-ylmethoxy)-5,6,7,8-tetrahydroquinoline;hydrochloride
CID 118290518
4-pyridazin-3-yl-2-(pyridin-2-ylmethoxy)-5,6,7,8-tetrahydroquinoline
CID 73336054
3-[2-(pyridin-2-ylmethoxy)-5,6,7,8-tetrahydroquinolin-4-yl]pyrazine-2-carbonitrile;hydrochloride
CID 118205334
5-[2-(pyridin-2-ylmethoxy)-5,6,7,8-tetrahydroquinolin-4-yl]pyrimidine-4-carbonitrile
CID 118205414
2-[(3-fluorophenyl)methoxy]-4-pyrimidin-5-yl-5,6,7,8-tetrahydroquinoline
CID 73335952
2-methoxy-4-(pyridin-2-ylmethoxy)-5,6,7,8-tetrahydroquinoline
CID 156783281
2-[(3,5-difluoro-2-pyridinyl)methoxy]-4-(2-methylpyrimidin-5-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 73334972
2-chloro-4-(pyridin-2-ylmethoxy)-5,6,7,8-tetrahydroquinoline
CID 118205484

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine?
The IUPAC name of 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine (CID 118205364) is 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine.
What is the SMILES notation for 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine?
The canonical SMILES for 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine is Fc1ncc(-c2cc(OCc3ccccn3)nc3c2CCC3)cn1.
What is the InChIKey of 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine?
The InChIKey is AZTFJMYGDHHRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN4O/c19-18-21-9-12(10-22-18)15-8-17(23-16-6-3-5-14(15)16)24-11-13-4-1-2-7-20-13/h1-2,4,7-10H,3,5-6,11H2.
What are the key properties of 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine?
4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine has a molecular weight of 322.34 g/mol, XLogP of 3.14, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoropyrimidin-5-yl)-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine is sourced from PubChem (CID 118205364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).