5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine

C11H10ClN5 — CID 3086326

IUPAC5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine
SMILESClc1c(NC2=NCCN2)ccc2nccnc12
InChIInChI=1S/C11H10ClN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17)
InChIKeyVJQWCCBDYLTRPZ-UHFFFAOYSA-N
MW247.69 g/mol
LogP1.65
Rot. Bonds1

About 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine

5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine (PubChem CID 3086326) has the molecular formula C11H10ClN5 and a molecular weight of 247.69 g/mol. Its IUPAC name is 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine.

Molecular Properties

Compound Name5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine
PubChem CID3086326
Molecular FormulaC11H10ClN5
Molecular Weight247.69 g/mol
Exact Mass247.06
IUPAC Name5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine
SMILESClc1c(NC2=NCCN2)ccc2nccnc12
InChIInChI=1S/C11H10ClN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17)
InChIKeyVJQWCCBDYLTRPZ-UHFFFAOYSA-N
XLogP1.65
TPSA62.20 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.69
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine?
The IUPAC name of 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine (CID 3086326) is 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine.
What is the SMILES notation for 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine?
The canonical SMILES for 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine is Clc1c(NC2=NCCN2)ccc2nccnc12.
What is the InChIKey of 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine?
The InChIKey is VJQWCCBDYLTRPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17).
What are the key properties of 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine?
5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine has a molecular weight of 247.69 g/mol, XLogP of 1.65, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine is sourced from PubChem (CID 3086326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).