5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one

C9H9NO — CID 134558287

IUPAC5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one
SMILESCC1C(=O)Cc2ncccc21
InChIInChI=1S/C9H9NO/c1-6-7-3-2-4-10-8(7)5-9(6)11/h2-4,6H,5H2,1H3
InChIKeyQQRJKEBXQNCASZ-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.31
Rot. Bonds

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

5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one (PubChem CID 134558287) has the molecular formula C9H9NO and a molecular weight of 147.18 g/mol. Its IUPAC name is 5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one.

Molecular Properties

Compound Name5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one
PubChem CID134558287
Molecular FormulaC9H9NO
Molecular Weight147.18 g/mol
Exact Mass147.07
IUPAC Name5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one
SMILESCC1C(=O)Cc2ncccc21
InChIInChI=1S/C9H9NO/c1-6-7-3-2-4-10-8(7)5-9(6)11/h2-4,6H,5H2,1H3
InChIKeyQQRJKEBXQNCASZ-UHFFFAOYSA-N
XLogP1.31
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 ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;5-methyl-7,8-dihydro-5H-1,7-naphthyridin-6-one
CID 142177834
5-methyl-5,10-dihydropyrido[4,3-g]quinoline
CID 58091555
ethane;1-methyl-1,3-dihydroinden-2-one
CID 91072401
(7S)-7-amino-5,6,7,9-tetrahydrocyclohepta[b]pyridin-8-one
CID 159433831
5-methyl-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine
CID 147578197
(5R)-5,6-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 58714676
5,7-dimethyl-5,6,7,8-tetrahydro-1,6-naphthyridine
CID 83970782
(2S,4R)-3-oxa-7-azatricyclo[4.4.0.02,4]deca-1(6),7,9-triene
CID 11434972
(5S)-2',4'-dimethylspiro[5,7-dihydrocyclopenta[b]pyridine-6,1'-cyclobutane]-5-amine
CID 167048296
5-methyl-6-propan-2-yl-5,7-dihydropyrrolo[3,4-b]pyridine
CID 170012584
5,11-dimethyl-5,6,11,12-tetrahydroquinolino[7,6-g]quinoxaline-6-thiol
CID 156572930
(5aR,7R,8aR)-7-methyl-5,5a,6,7,8,8a-hexahydropentaleno[2,1-b]pyridine
CID 154715452

Frequently Asked Questions

What is the IUPAC name of 5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one?
The IUPAC name of 5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one (CID 134558287) is 5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one.
What is the SMILES notation for 5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one?
The canonical SMILES for 5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one is CC1C(=O)Cc2ncccc21.
What is the InChIKey of 5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one?
The InChIKey is QQRJKEBXQNCASZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO/c1-6-7-3-2-4-10-8(7)5-9(6)11/h2-4,6H,5H2,1H3.
What are the key properties of 5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one?
5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one has a molecular weight of 147.18 g/mol, XLogP of 1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5,7-dihydrocyclopenta[b]pyridin-6-one is sourced from PubChem (CID 134558287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).