7-chloroimidazo[2,1-a]isoquinoline

C11H7ClN2 — CID 58517958

IUPAC7-chloroimidazo[2,1-a]isoquinoline
SMILESClc1cccc2c1ccn1ccnc21
InChIInChI=1S/C11H7ClN2/c12-10-3-1-2-9-8(10)4-6-14-7-5-13-11(9)14/h1-7H
InChIKeyVPFBCZFUKUHYEB-UHFFFAOYSA-N
MW202.64 g/mol
LogP3.14
Rot. Bonds

About 7-chloroimidazo[2,1-a]isoquinoline

7-chloroimidazo[2,1-a]isoquinoline (PubChem CID 58517958) has the molecular formula C11H7ClN2 and a molecular weight of 202.64 g/mol. Its IUPAC name is 7-chloroimidazo[2,1-a]isoquinoline.

Molecular Properties

Compound Name7-chloroimidazo[2,1-a]isoquinoline
PubChem CID58517958
Molecular FormulaC11H7ClN2
Molecular Weight202.64 g/mol
Exact Mass202.03
IUPAC Name7-chloroimidazo[2,1-a]isoquinoline
SMILESClc1cccc2c1ccn1ccnc21
InChIInChI=1S/C11H7ClN2/c12-10-3-1-2-9-8(10)4-6-14-7-5-13-11(9)14/h1-7H
InChIKeyVPFBCZFUKUHYEB-UHFFFAOYSA-N
XLogP3.14
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.64
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-quinolin-8-ylimidazo[2,1-a]isoquinoline
CID 58517751
3-bromo-7-chloroimidazo[2,1-a]isoquinoline
CID 115051768
7-(4-carbazol-9-ylphenyl)imidazo[2,1-a]isoquinoline
CID 58517577
8-(4-imidazo[2,1-a]isoquinolin-7-ylphenyl)-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58517960
CID 58517988
CID 58517988
6-phenylimidazo[2,1-a]isoquinoline
CID 58517625
sodium 8-chloroimidazo[1,2-a]pyridine-7-thiolate
CID 165387955
6-tert-butylimidazo[2,1-a]isoquinoline
CID 58518039
hydron;imidazo[1,2-c]quinazoline
CID 174874267
imidazo[1,2-a]pyridin-8-amine;hydrochloride
CID 118705200
3,6,10,13-tetrazatricyclo[7.4.0.02,6]trideca-1(13),2,4,7,9,11-hexaene
CID 130047223
imidazo[2,1-a]isoquinolin-8-yl(trimethyl)silane
CID 58517874

Frequently Asked Questions

What is the IUPAC name of 7-chloroimidazo[2,1-a]isoquinoline?
The IUPAC name of 7-chloroimidazo[2,1-a]isoquinoline (CID 58517958) is 7-chloroimidazo[2,1-a]isoquinoline.
What is the SMILES notation for 7-chloroimidazo[2,1-a]isoquinoline?
The canonical SMILES for 7-chloroimidazo[2,1-a]isoquinoline is Clc1cccc2c1ccn1ccnc21.
What is the InChIKey of 7-chloroimidazo[2,1-a]isoquinoline?
The InChIKey is VPFBCZFUKUHYEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN2/c12-10-3-1-2-9-8(10)4-6-14-7-5-13-11(9)14/h1-7H.
What are the key properties of 7-chloroimidazo[2,1-a]isoquinoline?
7-chloroimidazo[2,1-a]isoquinoline has a molecular weight of 202.64 g/mol, XLogP of 3.14, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloroimidazo[2,1-a]isoquinoline is sourced from PubChem (CID 58517958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).