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

C17H24N2O — CID 4534486

IUPACN-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide
SMILESCCCCC(=O)Nc1c2c(nc3c1CCC3)CCCC2
InChIInChI=1S/C17H24N2O/c1-2-3-11-16(20)19-17-12-7-4-5-9-14(12)18-15-10-6-8-13(15)17/h2-11H2,1H3,(H,18,19,20)
InChIKeyMDZVSHJCSPEQSK-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.58
Rot. Bonds4

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

N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide (PubChem CID 4534486) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide.

Molecular Properties

Compound NameN-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide
PubChem CID4534486
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide
SMILESCCCCC(=O)Nc1c2c(nc3c1CCC3)CCCC2
InChIInChI=1S/C17H24N2O/c1-2-3-11-16(20)19-17-12-7-4-5-9-14(12)18-15-10-6-8-13(15)17/h2-11H2,1H3,(H,18,19,20)
InChIKeyMDZVSHJCSPEQSK-UHFFFAOYSA-N
XLogP3.58
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.58
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)pentanamide?
The IUPAC name of N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide (CID 4534486) is N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide.
What is the SMILES notation for N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide?
The canonical SMILES for N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide is CCCCC(=O)Nc1c2c(nc3c1CCC3)CCCC2.
What is the InChIKey of N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide?
The InChIKey is MDZVSHJCSPEQSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-2-3-11-16(20)19-17-12-7-4-5-9-14(12)18-15-10-6-8-13(15)17/h2-11H2,1H3,(H,18,19,20).
What are the key properties of N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide?
N-(2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-yl)pentanamide has a molecular weight of 272.39 g/mol, XLogP of 3.58, 4 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)pentanamide is sourced from PubChem (CID 4534486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).