ethane;7-methyl-5H-cyclopenta[c]pyridine

C11H15N — CID 143933732

IUPACethane;7-methyl-5H-cyclopenta[c]pyridine
SMILESCC.CC1=CCc2ccncc21
InChIInChI=1S/C9H9N.C2H6/c1-7-2-3-8-4-5-10-6-9(7)8;1-2/h2,4-6H,3H2,1H3;1-2H3
InChIKeyGQVRFPHBJDXEMX-UHFFFAOYSA-N
MW161.25 g/mol
LogP3.07
Rot. Bonds

About ethane;7-methyl-5H-cyclopenta[c]pyridine

ethane;7-methyl-5H-cyclopenta[c]pyridine (PubChem CID 143933732) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is ethane;7-methyl-5H-cyclopenta[c]pyridine.

Molecular Properties

Compound Nameethane;7-methyl-5H-cyclopenta[c]pyridine
PubChem CID143933732
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Nameethane;7-methyl-5H-cyclopenta[c]pyridine
SMILESCC.CC1=CCc2ccncc21
InChIInChI=1S/C9H9N.C2H6/c1-7-2-3-8-4-5-10-6-9(7)8;1-2/h2,4-6H,3H2,1H3;1-2H3
InChIKeyGQVRFPHBJDXEMX-UHFFFAOYSA-N
XLogP3.07
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;7-methyl-5H-cyclopenta[c]pyridine?
The IUPAC name of ethane;7-methyl-5H-cyclopenta[c]pyridine (CID 143933732) is ethane;7-methyl-5H-cyclopenta[c]pyridine.
What is the SMILES notation for ethane;7-methyl-5H-cyclopenta[c]pyridine?
The canonical SMILES for ethane;7-methyl-5H-cyclopenta[c]pyridine is CC.CC1=CCc2ccncc21.
What is the InChIKey of ethane;7-methyl-5H-cyclopenta[c]pyridine?
The InChIKey is GQVRFPHBJDXEMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N.C2H6/c1-7-2-3-8-4-5-10-6-9(7)8;1-2/h2,4-6H,3H2,1H3;1-2H3.
What are the key properties of ethane;7-methyl-5H-cyclopenta[c]pyridine?
ethane;7-methyl-5H-cyclopenta[c]pyridine has a molecular weight of 161.25 g/mol, XLogP of 3.07, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-methyl-5H-cyclopenta[c]pyridine is sourced from PubChem (CID 143933732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).