N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide

C15H20N2O — CID 3238395

IUPACN-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide
SMILESCCC(=O)Nc1c2c(nc3c1CCC3)CCCC2
InChIInChI=1S/C15H20N2O/c1-2-14(18)17-15-10-6-3-4-8-12(10)16-13-9-5-7-11(13)15/h2-9H2,1H3,(H,16,17,18)
InChIKeyAHGYNPDGONVWAO-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.80
Rot. Bonds2

About N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide

N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide (PubChem CID 3238395) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide.

Molecular Properties

Compound NameN-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide
PubChem CID3238395
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide
SMILESCCC(=O)Nc1c2c(nc3c1CCC3)CCCC2
InChIInChI=1S/C15H20N2O/c1-2-14(18)17-15-10-6-3-4-8-12(10)16-13-9-5-7-11(13)15/h2-9H2,1H3,(H,16,17,18)
InChIKeyAHGYNPDGONVWAO-UHFFFAOYSA-N
XLogP2.80
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide?
The IUPAC name of N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide (CID 3238395) is N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide.
What is the SMILES notation for N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide?
The canonical SMILES for N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide is CCC(=O)Nc1c2c(nc3c1CCC3)CCCC2.
What is the InChIKey of N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide?
The InChIKey is AHGYNPDGONVWAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-2-14(18)17-15-10-6-3-4-8-12(10)16-13-9-5-7-11(13)15/h2-9H2,1H3,(H,16,17,18).
What are the key properties of N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide?
N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide has a molecular weight of 244.34 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)propanamide is sourced from PubChem (CID 3238395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).