N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

C20H27N3 — CID 110432415

IUPACN-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESc1ccc2c(NCCCCN3CCCC3)c3c(nc2c1)CCC3
InChIInChI=1S/C20H27N3/c1-2-10-18-16(8-1)20(17-9-7-11-19(17)22-18)21-12-3-4-13-23-14-5-6-15-23/h1-2,8,10H,3-7,9,11-15H2,(H,21,22)
InChIKeyACDXLQKBCDMJOB-UHFFFAOYSA-N
MW309.46 g/mol
LogP4.01
Rot. Bonds6

About N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 110432415) has the molecular formula C20H27N3 and a molecular weight of 309.46 g/mol. Its IUPAC name is N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound NameN-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID110432415
Molecular FormulaC20H27N3
Molecular Weight309.46 g/mol
Exact Mass309.22
IUPAC NameN-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESc1ccc2c(NCCCCN3CCCC3)c3c(nc2c1)CCC3
InChIInChI=1S/C20H27N3/c1-2-10-18-16(8-1)20(17-9-7-11-19(17)22-18)21-12-3-4-13-23-14-5-6-15-23/h1-2,8,10H,3-7,9,11-15H2,(H,21,22)
InChIKeyACDXLQKBCDMJOB-UHFFFAOYSA-N
XLogP4.01
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.46
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine 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

N-(9-morpholin-4-ylnonyl)-1,2,3,4-tetrahydroacridin-9-amine
CID 54768920
N,N'-bis(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)hexane-1,6-diamine
CID 15490813
N,N'-bis(1,2,3,4-tetrahydroacridin-9-yl)decane-1,10-diamine;dihydrochloride
CID 23644646
1-[3-(1,2,3,4-tetrahydroacridin-9-ylamino)propyl]piperidin-4-ol
CID 67618555
N-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]propyl]-1,2,3,4-tetrahydroacridin-9-amine
CID 11826604
N-phenyl-N'-(1,2,3,4-tetrahydroacridin-9-yl)dodecane-1,12-diamine
CID 46889316
4-(1,2,3,4-tetrahydroacridin-9-ylamino)butylcarbamic acid
CID 118035689
N-(2-piperidin-1-ylethyl)acridin-9-amine
CID 4976664
N-octyl-1,2,3,4-tetrahydroacridin-9-amine
CID 10018304
2-[8-(1,2,3,4-tetrahydroacridin-9-ylamino)octyl]isoindole-1,3-dione
CID 10344005
N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62202711
N'-(1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7-diamine;hydrochloride
CID 45265092

Frequently Asked Questions

What is the IUPAC name of N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 110432415) is N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is c1ccc2c(NCCCCN3CCCC3)c3c(nc2c1)CCC3.
What is the InChIKey of N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is ACDXLQKBCDMJOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3/c1-2-10-18-16(8-1)20(17-9-7-11-19(17)22-18)21-12-3-4-13-23-14-5-6-15-23/h1-2,8,10H,3-7,9,11-15H2,(H,21,22).
What are the key properties of N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 309.46 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyrrolidin-1-ylbutyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 110432415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).