3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one

C13H16N2O — CID 155891050

IUPAC3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one
SMILESCc1cnc2c(c1)C(=O)C1(CCNCC1)C2
InChIInChI=1S/C13H16N2O/c1-9-6-10-11(15-8-9)7-13(12(10)16)2-4-14-5-3-13/h6,8,14H,2-5,7H2,1H3
InChIKeyZBPSJCYJZVMKIX-UHFFFAOYSA-N
MW216.28 g/mol
LogP1.50
Rot. Bonds

About 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one

3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one (PubChem CID 155891050) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one.

Molecular Properties

Compound Name3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one
PubChem CID155891050
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one
SMILESCc1cnc2c(c1)C(=O)C1(CCNCC1)C2
InChIInChI=1S/C13H16N2O/c1-9-6-10-11(15-8-9)7-13(12(10)16)2-4-14-5-3-13/h6,8,14H,2-5,7H2,1H3
InChIKeyZBPSJCYJZVMKIX-UHFFFAOYSA-N
XLogP1.50
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-methylspiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;hydrochloride
CID 178145475
6-fluorospiro[3H-indene-2,4'-piperidine]-1-one
CID 175058607
6-chloro-5-methoxyspiro[3H-indene-2,4'-piperidine]-1-one
CID 155164211
6-methylspiro[3H-indene-2,7'-5,6,8,9-tetrahydrocyclohepta[d]pyridazine]-1-one
CID 91546187
ethane;6-methyl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one
CID 171527396
tert-butyl 3-fluoro-5-oxospiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-1'-carboxylate
CID 146485823
7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one
CID 170134760
6-methyl-1,1-dioxospiro[3H-thiochromene-2,4'-piperidine]-4-one;hydrochloride
CID 68664900
3-methyl-7H-pyrrolo[3,4-b]pyridine
CID 158638402
3,7-dimethyl-1,4-dihydropyrido[3,2-d]pyrimidin-2-one;ethane
CID 170981748
3,6-dimethylpyrrolo[3,4-b]pyridine-5,7-dione
CID 19352217
8-methylspiro[4,5-dihydro-1H-pyrido[2,3-b][1,4]diazepine-3,1'-cyclopropane]-2-one
CID 115452149

Frequently Asked Questions

What is the IUPAC name of 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one?
The IUPAC name of 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one (CID 155891050) is 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one.
What is the SMILES notation for 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one?
The canonical SMILES for 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one is Cc1cnc2c(c1)C(=O)C1(CCNCC1)C2.
What is the InChIKey of 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one?
The InChIKey is ZBPSJCYJZVMKIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-9-6-10-11(15-8-9)7-13(12(10)16)2-4-14-5-3-13/h6,8,14H,2-5,7H2,1H3.
What are the key properties of 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one?
3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one has a molecular weight of 216.28 g/mol, XLogP of 1.50, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one is sourced from PubChem (CID 155891050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).