7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride

C13H20Cl2N2 — CID 52983751

IUPAC7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride
SMILESCl.Cl.c1cc2c(cc1N1CCCC1)NCCC2
InChIInChI=1S/C13H18N2.2ClH/c1-2-9-15(8-1)12-6-5-11-4-3-7-14-13(11)10-12;;/h5-6,10,14H,1-4,7-9H2;2*1H
InChIKeyABBOIOMPFGGUQU-UHFFFAOYSA-N
MW275.22 g/mol
LogP3.49
Rot. Bonds1

About 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride

7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride (PubChem CID 52983751) has the molecular formula C13H20Cl2N2 and a molecular weight of 275.22 g/mol. Its IUPAC name is 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride.

Molecular Properties

Compound Name7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride
PubChem CID52983751
Molecular FormulaC13H20Cl2N2
Molecular Weight275.22 g/mol
Exact Mass274.10
IUPAC Name7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride
SMILESCl.Cl.c1cc2c(cc1N1CCCC1)NCCC2
InChIInChI=1S/C13H18N2.2ClH/c1-2-9-15(8-1)12-6-5-11-4-3-7-14-13(11)10-12;;/h5-6,10,14H,1-4,7-9H2;2*1H
InChIKeyABBOIOMPFGGUQU-UHFFFAOYSA-N
XLogP3.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.22
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride?
The IUPAC name of 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride (CID 52983751) is 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride.
What is the SMILES notation for 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride?
The canonical SMILES for 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride is Cl.Cl.c1cc2c(cc1N1CCCC1)NCCC2.
What is the InChIKey of 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride?
The InChIKey is ABBOIOMPFGGUQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2.2ClH/c1-2-9-15(8-1)12-6-5-11-4-3-7-14-13(11)10-12;;/h5-6,10,14H,1-4,7-9H2;2*1H.
What are the key properties of 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride?
7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride has a molecular weight of 275.22 g/mol, XLogP of 3.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline;dihydrochloride is sourced from PubChem (CID 52983751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).