1-propan-2-yl-5H-cyclopenta[c]pyridine

C11H13N — CID 157336279

IUPAC1-propan-2-yl-5H-cyclopenta[c]pyridine
SMILESCC(C)c1nccc2c1C=CC2
InChIInChI=1S/C11H13N/c1-8(2)11-10-5-3-4-9(10)6-7-12-11/h3,5-8H,4H2,1-2H3
InChIKeyMCWADNRAKHPWDI-UHFFFAOYSA-N
MW159.23 g/mol
LogP2.77
Rot. Bonds1

About 1-propan-2-yl-5H-cyclopenta[c]pyridine

1-propan-2-yl-5H-cyclopenta[c]pyridine (PubChem CID 157336279) has the molecular formula C11H13N and a molecular weight of 159.23 g/mol. Its IUPAC name is 1-propan-2-yl-5H-cyclopenta[c]pyridine.

Molecular Properties

Compound Name1-propan-2-yl-5H-cyclopenta[c]pyridine
PubChem CID157336279
Molecular FormulaC11H13N
Molecular Weight159.23 g/mol
Exact Mass159.10
IUPAC Name1-propan-2-yl-5H-cyclopenta[c]pyridine
SMILESCC(C)c1nccc2c1C=CC2
InChIInChI=1S/C11H13N/c1-8(2)11-10-5-3-4-9(10)6-7-12-11/h3,5-8H,4H2,1-2H3
InChIKeyMCWADNRAKHPWDI-UHFFFAOYSA-N
XLogP2.77
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-5H-cyclopenta[c]pyridine?
The IUPAC name of 1-propan-2-yl-5H-cyclopenta[c]pyridine (CID 157336279) is 1-propan-2-yl-5H-cyclopenta[c]pyridine.
What is the SMILES notation for 1-propan-2-yl-5H-cyclopenta[c]pyridine?
The canonical SMILES for 1-propan-2-yl-5H-cyclopenta[c]pyridine is CC(C)c1nccc2c1C=CC2.
What is the InChIKey of 1-propan-2-yl-5H-cyclopenta[c]pyridine?
The InChIKey is MCWADNRAKHPWDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N/c1-8(2)11-10-5-3-4-9(10)6-7-12-11/h3,5-8H,4H2,1-2H3.
What are the key properties of 1-propan-2-yl-5H-cyclopenta[c]pyridine?
1-propan-2-yl-5H-cyclopenta[c]pyridine has a molecular weight of 159.23 g/mol, XLogP of 2.77, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-5H-cyclopenta[c]pyridine is sourced from PubChem (CID 157336279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).