4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one

C9H9NO — CID 10464470

IUPAC4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one
SMILESCc1cncc2c1CCC2=O
InChIInChI=1S/C9H9NO/c1-6-4-10-5-8-7(6)2-3-9(8)11/h4-5H,2-3H2,1H3
InChIKeyDAJRPQGJOXMXSW-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.52
Rot. Bonds

About 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one

4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one (PubChem CID 10464470) has the molecular formula C9H9NO and a molecular weight of 147.18 g/mol. Its IUPAC name is 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one.

Molecular Properties

Compound Name4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one
PubChem CID10464470
Molecular FormulaC9H9NO
Molecular Weight147.18 g/mol
Exact Mass147.07
IUPAC Name4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one
SMILESCc1cncc2c1CCC2=O
InChIInChI=1S/C9H9NO/c1-6-4-10-5-8-7(6)2-3-9(8)11/h4-5H,2-3H2,1H3
InChIKeyDAJRPQGJOXMXSW-UHFFFAOYSA-N
XLogP1.52
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one?
The IUPAC name of 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one (CID 10464470) is 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one.
What is the SMILES notation for 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one?
The canonical SMILES for 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one is Cc1cncc2c1CCC2=O.
What is the InChIKey of 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one?
The InChIKey is DAJRPQGJOXMXSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO/c1-6-4-10-5-8-7(6)2-3-9(8)11/h4-5H,2-3H2,1H3.
What are the key properties of 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one?
4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one has a molecular weight of 147.18 g/mol, XLogP of 1.52, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5,6-dihydrocyclopenta[c]pyridin-7-one is sourced from PubChem (CID 10464470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).