2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine

C18H23N3 — CID 115559387

IUPAC2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine
SMILESNCC(c1cccc2cccnc12)N1CC2CCCC2C1
InChIInChI=1S/C18H23N3/c19-10-17(21-11-14-5-1-6-15(14)12-21)16-8-2-4-13-7-3-9-20-18(13)16/h2-4,7-9,14-15,17H,1,5-6,10-12,19H2
InChIKeyYPNYLAABINPNAN-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.97
Rot. Bonds3

About 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine

2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine (PubChem CID 115559387) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine.

Molecular Properties

Compound Name2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine
PubChem CID115559387
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine
SMILESNCC(c1cccc2cccnc12)N1CC2CCCC2C1
InChIInChI=1S/C18H23N3/c19-10-17(21-11-14-5-1-6-15(14)12-21)16-8-2-4-13-7-3-9-20-18(13)16/h2-4,7-9,14-15,17H,1,5-6,10-12,19H2
InChIKeyYPNYLAABINPNAN-UHFFFAOYSA-N
XLogP2.97
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-naphthalen-1-ylethanamine
CID 115559288
2-[3-(methoxymethyl)pyrrolidin-1-yl]-2-quinolin-8-ylethanamine
CID 64568893
6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine
CID 105021197
1-quinolin-8-ylethane-1,2-diamine
CID 63968089
3-methyl-2-quinolin-8-ylbutan-1-amine
CID 83886423
N-(4-methylpiperazin-1-yl)-1-quinolin-8-ylethane-1,2-diamine
CID 83010794
2-cyclopentyl-1-quinolin-8-ylethanol
CID 65149248
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-(2-chloro-6-fluorophenyl)ethanamine
CID 115559256
1-cyclohexyl-2-quinolin-8-ylethane-1,2-diol
CID 103459066
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 115559424
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-(3-methylthiophen-2-yl)ethanamine
CID 113335529
N-(3-methylcyclopentyl)-1-quinolin-8-ylethane-1,2-diamine
CID 114544546

Frequently Asked Questions

What is the IUPAC name of 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine?
The IUPAC name of 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine (CID 115559387) is 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine.
What is the SMILES notation for 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine?
The canonical SMILES for 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine is NCC(c1cccc2cccnc12)N1CC2CCCC2C1.
What is the InChIKey of 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine?
The InChIKey is YPNYLAABINPNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c19-10-17(21-11-14-5-1-6-15(14)12-21)16-8-2-4-13-7-3-9-20-18(13)16/h2-4,7-9,14-15,17H,1,5-6,10-12,19H2.
What are the key properties of 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine?
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine has a molecular weight of 281.40 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine is sourced from PubChem (CID 115559387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).