5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine

C12H11N5 — CID 67408304

IUPAC5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine
SMILESCc1nc2ccccc2nc1-c1cc(N)n[nH]1
InChIInChI=1S/C12H11N5/c1-7-12(10-6-11(13)17-16-10)15-9-5-3-2-4-8(9)14-7/h2-6H,1H3,(H3,13,16,17)
InChIKeyRCQMSGVKAIRXQE-UHFFFAOYSA-N
MW225.26 g/mol
LogP1.91
Rot. Bonds1

About 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine

5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine (PubChem CID 67408304) has the molecular formula C12H11N5 and a molecular weight of 225.26 g/mol. Its IUPAC name is 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine
PubChem CID67408304
Molecular FormulaC12H11N5
Molecular Weight225.26 g/mol
Exact Mass225.10
IUPAC Name5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine
SMILESCc1nc2ccccc2nc1-c1cc(N)n[nH]1
InChIInChI=1S/C12H11N5/c1-7-12(10-6-11(13)17-16-10)15-9-5-3-2-4-8(9)14-7/h2-6H,1H3,(H3,13,16,17)
InChIKeyRCQMSGVKAIRXQE-UHFFFAOYSA-N
XLogP1.91
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine (CID 67408304) is 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine is Cc1nc2ccccc2nc1-c1cc(N)n[nH]1.
What is the InChIKey of 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine?
The InChIKey is RCQMSGVKAIRXQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5/c1-7-12(10-6-11(13)17-16-10)15-9-5-3-2-4-8(9)14-7/h2-6H,1H3,(H3,13,16,17).
What are the key properties of 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine?
5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine has a molecular weight of 225.26 g/mol, XLogP of 1.91, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methylquinoxalin-2-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 67408304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).