3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one

C12H15NO — CID 158044028

IUPAC3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one
SMILESCc1cc2c([nH]c1=O)C(C(C)C)=CC2
InChIInChI=1S/C12H15NO/c1-7(2)10-5-4-9-6-8(3)12(14)13-11(9)10/h5-7H,4H2,1-3H3,(H,13,14)
InChIKeyQEYKAMHRRXAYQF-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.28
Rot. Bonds1

About 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one

3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one (PubChem CID 158044028) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one.

Molecular Properties

Compound Name3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one
PubChem CID158044028
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one
SMILESCc1cc2c([nH]c1=O)C(C(C)C)=CC2
InChIInChI=1S/C12H15NO/c1-7(2)10-5-4-9-6-8(3)12(14)13-11(9)10/h5-7H,4H2,1-3H3,(H,13,14)
InChIKeyQEYKAMHRRXAYQF-UHFFFAOYSA-N
XLogP2.28
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-5,6-di(propan-2-yl)-1H-pyridin-2-one
CID 58327584
5-methyl-3,7-dihydro-2H-thieno[2,3-b]pyridin-6-one
CID 14198229
6-methyl-3-propan-2-yl-1,4-dihydropyrrolo[3,2-b]pyridin-5-one
CID 129129649
3-methyl-1,5,6,7,8,9-hexahydrocyclohepta[b]pyridin-2-one
CID 146432464
3-methyl-6-propan-2-yl-5,6,7,8-tetrahydro-1H-quinolin-2-one
CID 82112815
5,6-dimethyl-3-propan-2-yl-1H-pyridin-2-one
CID 91057359
3-methyl-1H-benzo[g]quinoline-2,5,10-trione
CID 10130968
3-methyl-6,7-dihydro-1H-quinolin-2-one
CID 144546014
3-(difluoromethyl)-5-methyl-6-oxo-1H-pyridine-2-carbonitrile
CID 130076475
5,6-bis(4-fluorophenyl)-3-methyl-1H-pyridin-2-one
CID 118316459
6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one
CID 144545636
5-methyl-2-oxo-6-(4-propan-2-ylphenyl)-1H-pyridine-3-carbonitrile
CID 82119661

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one?
The IUPAC name of 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one (CID 158044028) is 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one.
What is the SMILES notation for 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one?
The canonical SMILES for 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one is Cc1cc2c([nH]c1=O)C(C(C)C)=CC2.
What is the InChIKey of 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one?
The InChIKey is QEYKAMHRRXAYQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-7(2)10-5-4-9-6-8(3)12(14)13-11(9)10/h5-7H,4H2,1-3H3,(H,13,14).
What are the key properties of 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one?
3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one has a molecular weight of 189.26 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one is sourced from PubChem (CID 158044028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).