5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine

C17H13FN6 — CID 44571364

IUPAC5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine
SMILESCc1nc(-c2[nH]c(N)nc2-c2ccc3nccnc3c2)ccc1F
InChIInChI=1S/C17H13FN6/c1-9-11(18)3-5-13(22-9)16-15(23-17(19)24-16)10-2-4-12-14(8-10)21-7-6-20-12/h2-8H,1H3,(H3,19,23,24)
InChIKeyAZDQJYNHHKSZIJ-UHFFFAOYSA-N
MW320.33 g/mol
LogP3.11
Rot. Bonds2

About 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine

5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine (PubChem CID 44571364) has the molecular formula C17H13FN6 and a molecular weight of 320.33 g/mol. Its IUPAC name is 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine
PubChem CID44571364
Molecular FormulaC17H13FN6
Molecular Weight320.33 g/mol
Exact Mass320.12
IUPAC Name5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine
SMILESCc1nc(-c2[nH]c(N)nc2-c2ccc3nccnc3c2)ccc1F
InChIInChI=1S/C17H13FN6/c1-9-11(18)3-5-13(22-9)16-15(23-17(19)24-16)10-2-4-12-14(8-10)21-7-6-20-12/h2-8H,1H3,(H3,19,23,24)
InChIKeyAZDQJYNHHKSZIJ-UHFFFAOYSA-N
XLogP3.11
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.33
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine?
The IUPAC name of 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine (CID 44571364) is 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine.
What is the SMILES notation for 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine?
The canonical SMILES for 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine is Cc1nc(-c2[nH]c(N)nc2-c2ccc3nccnc3c2)ccc1F.
What is the InChIKey of 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine?
The InChIKey is AZDQJYNHHKSZIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN6/c1-9-11(18)3-5-13(22-9)16-15(23-17(19)24-16)10-2-4-12-14(8-10)21-7-6-20-12/h2-8H,1H3,(H3,19,23,24).
What are the key properties of 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine?
5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine has a molecular weight of 320.33 g/mol, XLogP of 3.11, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-fluoro-6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-amine is sourced from PubChem (CID 44571364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).