3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine

C9H10FN — CID 177053588

IUPAC3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESCC1Cc2cc(F)cnc2C1
InChIInChI=1S/C9H10FN/c1-6-2-7-4-8(10)5-11-9(7)3-6/h4-6H,2-3H2,1H3
InChIKeyRZZBEBQYEJISQP-UHFFFAOYSA-N
MW151.18 g/mol
LogP1.96
Rot. Bonds

About 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine

3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine (PubChem CID 177053588) has the molecular formula C9H10FN and a molecular weight of 151.18 g/mol. Its IUPAC name is 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine.

Molecular Properties

Compound Name3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
PubChem CID177053588
Molecular FormulaC9H10FN
Molecular Weight151.18 g/mol
Exact Mass151.08
IUPAC Name3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESCC1Cc2cc(F)cnc2C1
InChIInChI=1S/C9H10FN/c1-6-2-7-4-8(10)5-11-9(7)3-6/h4-6H,2-3H2,1H3
InChIKeyRZZBEBQYEJISQP-UHFFFAOYSA-N
XLogP1.96
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.18
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine?
The IUPAC name of 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine (CID 177053588) is 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine.
What is the SMILES notation for 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine?
The canonical SMILES for 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine is CC1Cc2cc(F)cnc2C1.
What is the InChIKey of 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine?
The InChIKey is RZZBEBQYEJISQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN/c1-6-2-7-4-8(10)5-11-9(7)3-6/h4-6H,2-3H2,1H3.
What are the key properties of 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine?
3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine has a molecular weight of 151.18 g/mol, XLogP of 1.96, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine is sourced from PubChem (CID 177053588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).