2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one

C9H11NO — CID 14732816

IUPAC2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one
SMILESCn1ccc2c(c1=O)CCC2
InChIInChI=1S/C9H11NO/c1-10-6-5-7-3-2-4-8(7)9(10)11/h5-6H,2-4H2,1H3
InChIKeyVRSHHNARTMQNDP-UHFFFAOYSA-N
MW149.19 g/mol
LogP0.87
Rot. Bonds

About 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one

2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one (PubChem CID 14732816) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one.

Molecular Properties

Compound Name2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one
PubChem CID14732816
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one
SMILESCn1ccc2c(c1=O)CCC2
InChIInChI=1S/C9H11NO/c1-10-6-5-7-3-2-4-8(7)9(10)11/h5-6H,2-4H2,1H3
InChIKeyVRSHHNARTMQNDP-UHFFFAOYSA-N
XLogP0.87
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one?
The IUPAC name of 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one (CID 14732816) is 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one.
What is the SMILES notation for 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one?
The canonical SMILES for 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one is Cn1ccc2c(c1=O)CCC2.
What is the InChIKey of 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one?
The InChIKey is VRSHHNARTMQNDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-10-6-5-7-3-2-4-8(7)9(10)11/h5-6H,2-4H2,1H3.
What are the key properties of 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one?
2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one has a molecular weight of 149.19 g/mol, XLogP of 0.87, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-1-one is sourced from PubChem (CID 14732816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).