1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone

C18H24N2O — CID 68500746

IUPAC1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone
SMILESO=C(N1CCCCC1)C12CCCNC1c1ccccc1C2
InChIInChI=1S/C18H24N2O/c21-17(20-11-4-1-5-12-20)18-9-6-10-19-16(18)15-8-3-2-7-14(15)13-18/h2-3,7-8,16,19H,1,4-6,9-13H2
InChIKeyKELHVLSVOJIHOO-UHFFFAOYSA-N
MW284.40 g/mol
LogP2.67
Rot. Bonds1

About 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone

1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone (PubChem CID 68500746) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone.

Molecular Properties

Compound Name1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone
PubChem CID68500746
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone
SMILESO=C(N1CCCCC1)C12CCCNC1c1ccccc1C2
InChIInChI=1S/C18H24N2O/c21-17(20-11-4-1-5-12-20)18-9-6-10-19-16(18)15-8-3-2-7-14(15)13-18/h2-3,7-8,16,19H,1,4-6,9-13H2
InChIKeyKELHVLSVOJIHOO-UHFFFAOYSA-N
XLogP2.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone with MolForge

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Related Compounds

1-piperidin-1-yl-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)ethanone
CID 82089589
(4aR,9bS)-4a-phenyl-1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridine
CID 129392517
(3R)-1-(1,2,3,4-tetrahydroisoquinoline-1-carbonyl)piperidine-3-carboxylic acid
CID 81127897
2-(2,3-dihydro-1H-isoindol-1-yl)-1-pyrrolidin-1-ylethanone
CID 115104686
8-(1,2,3,4-tetrahydroisoquinolin-1-yl)spiro[4.5]decan-8-ol
CID 114819645
piperidin-1-yl(1,2,3,4-tetrahydroisoquinolin-4-yl)methanone
CID 65260359
(4aR,10bS)-4a-(methoxymethyl)-2,3,4,5,6,10b-hexahydro-1H-benzo[h]quinoline
CID 59542246
2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone
CID 43411240
N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide
CID 54412767
2-methylsulfonyl-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)cyclopentan-1-ol
CID 65050091
(4aS,8aS)-7-(2-fluorobenzoyl)-1,2,3,4,5,6,8,8a-octahydro-1,7-naphthyridine-4a-carboxylic acid;hydrochloride
CID 154915970
2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylpropan-1-one
CID 43411283

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone?
The IUPAC name of 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone (CID 68500746) is 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone.
What is the SMILES notation for 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone?
The canonical SMILES for 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone is O=C(N1CCCCC1)C12CCCNC1c1ccccc1C2.
What is the InChIKey of 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone?
The InChIKey is KELHVLSVOJIHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c21-17(20-11-4-1-5-12-20)18-9-6-10-19-16(18)15-8-3-2-7-14(15)13-18/h2-3,7-8,16,19H,1,4-6,9-13H2.
What are the key properties of 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone?
1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone has a molecular weight of 284.40 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridin-4a-yl(piperidin-1-yl)methanone is sourced from PubChem (CID 68500746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).