8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline

C18H14ClN5 — CID 110222945

IUPAC8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline
SMILESClc1ccc2c(c1)NC(c1cccc3nccnc13)N1CCN=C21
InChIInChI=1S/C18H14ClN5/c19-11-4-5-12-15(10-11)23-18(24-9-8-22-17(12)24)13-2-1-3-14-16(13)21-7-6-20-14/h1-7,10,18,23H,8-9H2
InChIKeyFUCOAUVAYYCAFA-UHFFFAOYSA-N
MW335.80 g/mol
LogP3.47
Rot. Bonds1

About 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline

8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline (PubChem CID 110222945) has the molecular formula C18H14ClN5 and a molecular weight of 335.80 g/mol. Its IUPAC name is 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline.

Molecular Properties

Compound Name8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline
PubChem CID110222945
Molecular FormulaC18H14ClN5
Molecular Weight335.80 g/mol
Exact Mass335.09
IUPAC Name8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline
SMILESClc1ccc2c(c1)NC(c1cccc3nccnc13)N1CCN=C21
InChIInChI=1S/C18H14ClN5/c19-11-4-5-12-15(10-11)23-18(24-9-8-22-17(12)24)13-2-1-3-14-16(13)21-7-6-20-14/h1-7,10,18,23H,8-9H2
InChIKeyFUCOAUVAYYCAFA-UHFFFAOYSA-N
XLogP3.47
TPSA53.41 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.80
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline?
The IUPAC name of 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline (CID 110222945) is 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline.
What is the SMILES notation for 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline?
The canonical SMILES for 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline is Clc1ccc2c(c1)NC(c1cccc3nccnc13)N1CCN=C21.
What is the InChIKey of 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline?
The InChIKey is FUCOAUVAYYCAFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN5/c19-11-4-5-12-15(10-11)23-18(24-9-8-22-17(12)24)13-2-1-3-14-16(13)21-7-6-20-14/h1-7,10,18,23H,8-9H2.
What are the key properties of 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline?
8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline has a molecular weight of 335.80 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-5-quinoxalin-5-yl-2,3,5,6-tetrahydroimidazo[1,2-c]quinazoline is sourced from PubChem (CID 110222945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).