(2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone

C15H17N5O — CID 63777378

IUPAC(2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone
SMILESCN1CCN(C(=O)c2cccnc2NN)c2ccccc21
InChIInChI=1S/C15H17N5O/c1-19-9-10-20(13-7-3-2-6-12(13)19)15(21)11-5-4-8-17-14(11)18-16/h2-8H,9-10,16H2,1H3,(H,17,18)
InChIKeyGDPFZNCOJSQMRU-UHFFFAOYSA-N
MW283.34 g/mol
LogP1.46
Rot. Bonds2

About (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone

(2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone (PubChem CID 63777378) has the molecular formula C15H17N5O and a molecular weight of 283.34 g/mol. Its IUPAC name is (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone.

Molecular Properties

Compound Name(2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone
PubChem CID63777378
Molecular FormulaC15H17N5O
Molecular Weight283.34 g/mol
Exact Mass283.14
IUPAC Name(2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone
SMILESCN1CCN(C(=O)c2cccnc2NN)c2ccccc21
InChIInChI=1S/C15H17N5O/c1-19-9-10-20(13-7-3-2-6-12(13)19)15(21)11-5-4-8-17-14(11)18-16/h2-8H,9-10,16H2,1H3,(H,17,18)
InChIKeyGDPFZNCOJSQMRU-UHFFFAOYSA-N
XLogP1.46
TPSA74.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone?
The IUPAC name of (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone (CID 63777378) is (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone.
What is the SMILES notation for (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone?
The canonical SMILES for (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone is CN1CCN(C(=O)c2cccnc2NN)c2ccccc21.
What is the InChIKey of (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone?
The InChIKey is GDPFZNCOJSQMRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c1-19-9-10-20(13-7-3-2-6-12(13)19)15(21)11-5-4-8-17-14(11)18-16/h2-8H,9-10,16H2,1H3,(H,17,18).
What are the key properties of (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone?
(2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone has a molecular weight of 283.34 g/mol, XLogP of 1.46, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydrazinyl-3-pyridinyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone is sourced from PubChem (CID 63777378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).