8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline

C18H12ClN5 — CID 126712422

IUPAC8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline
SMILESClc1ccc2ncc3[nH]c(Cc4cn5ccccc5n4)nc3c2c1
InChIInChI=1S/C18H12ClN5/c19-11-4-5-14-13(7-11)18-15(9-20-14)22-16(23-18)8-12-10-24-6-2-1-3-17(24)21-12/h1-7,9-10H,8H2,(H,22,23)
InChIKeySUWWQJXZLKIMOY-UHFFFAOYSA-N
MW333.78 g/mol
LogP4.00
Rot. Bonds2

About 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline

8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline (PubChem CID 126712422) has the molecular formula C18H12ClN5 and a molecular weight of 333.78 g/mol. Its IUPAC name is 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline
PubChem CID126712422
Molecular FormulaC18H12ClN5
Molecular Weight333.78 g/mol
Exact Mass333.08
IUPAC Name8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline
SMILESClc1ccc2ncc3[nH]c(Cc4cn5ccccc5n4)nc3c2c1
InChIInChI=1S/C18H12ClN5/c19-11-4-5-14-13(7-11)18-15(9-20-14)22-16(23-18)8-12-10-24-6-2-1-3-17(24)21-12/h1-7,9-10H,8H2,(H,22,23)
InChIKeySUWWQJXZLKIMOY-UHFFFAOYSA-N
XLogP4.00
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.78
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline?
The IUPAC name of 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline (CID 126712422) is 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline.
What is the SMILES notation for 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline?
The canonical SMILES for 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline is Clc1ccc2ncc3[nH]c(Cc4cn5ccccc5n4)nc3c2c1.
What is the InChIKey of 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline?
The InChIKey is SUWWQJXZLKIMOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClN5/c19-11-4-5-14-13(7-11)18-15(9-20-14)22-16(23-18)8-12-10-24-6-2-1-3-17(24)21-12/h1-7,9-10H,8H2,(H,22,23).
What are the key properties of 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline?
8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline has a molecular weight of 333.78 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline is sourced from PubChem (CID 126712422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).