(3-methyl-1,8-phenanthrolin-2-yl)hydrazine

C13H12N4 — CID 63232790

IUPAC(3-methyl-1,8-phenanthrolin-2-yl)hydrazine
SMILESCc1cc2ccc3cnccc3c2nc1NN
InChIInChI=1S/C13H12N4/c1-8-6-9-2-3-10-7-15-5-4-11(10)12(9)16-13(8)17-14/h2-7H,14H2,1H3,(H,16,17)
InChIKeyVLGXSCBBXKXJII-UHFFFAOYSA-N
MW224.27 g/mol
LogP2.38
Rot. Bonds1

About (3-methyl-1,8-phenanthrolin-2-yl)hydrazine

(3-methyl-1,8-phenanthrolin-2-yl)hydrazine (PubChem CID 63232790) has the molecular formula C13H12N4 and a molecular weight of 224.27 g/mol. Its IUPAC name is (3-methyl-1,8-phenanthrolin-2-yl)hydrazine.

Molecular Properties

Compound Name(3-methyl-1,8-phenanthrolin-2-yl)hydrazine
PubChem CID63232790
Molecular FormulaC13H12N4
Molecular Weight224.27 g/mol
Exact Mass224.11
IUPAC Name(3-methyl-1,8-phenanthrolin-2-yl)hydrazine
SMILESCc1cc2ccc3cnccc3c2nc1NN
InChIInChI=1S/C13H12N4/c1-8-6-9-2-3-10-7-15-5-4-11(10)12(9)16-13(8)17-14/h2-7H,14H2,1H3,(H,16,17)
InChIKeyVLGXSCBBXKXJII-UHFFFAOYSA-N
XLogP2.38
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

(3-propyl-1,8-phenanthrolin-2-yl)hydrazine
CID 63232788
(3,9-dimethyl-1,10-phenanthrolin-2-yl)hydrazine
CID 63233164
(3-methyl-1,10-phenanthrolin-2-yl)hydrazine
CID 63232745
3,8-phenanthroline
CID 13064691
benzo[f]isoquinolin-8-amine
CID 101109295
(3-methyl-8-piperidin-1-ylquinolin-2-yl)hydrazine
CID 63232241
6-N-(4-fluoro-2-methylphenyl)isoquinoline-5,6-diamine
CID 106947584
[(3,4-dimethylphenyl)-isoquinolin-5-ylmethyl]hydrazine
CID 105303015
[1,2]oxazolo[3,4-f]isoquinoline
CID 91665541
(6-methylisoquinolin-5-yl)sulfanylurea
CID 174380938
6-methylisoquinoline-5-carbonyl chloride
CID 125452017
ethane;isoquinolin-6-amine
CID 143931414

Frequently Asked Questions

What is the IUPAC name of (3-methyl-1,8-phenanthrolin-2-yl)hydrazine?
The IUPAC name of (3-methyl-1,8-phenanthrolin-2-yl)hydrazine (CID 63232790) is (3-methyl-1,8-phenanthrolin-2-yl)hydrazine.
What is the SMILES notation for (3-methyl-1,8-phenanthrolin-2-yl)hydrazine?
The canonical SMILES for (3-methyl-1,8-phenanthrolin-2-yl)hydrazine is Cc1cc2ccc3cnccc3c2nc1NN.
What is the InChIKey of (3-methyl-1,8-phenanthrolin-2-yl)hydrazine?
The InChIKey is VLGXSCBBXKXJII-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4/c1-8-6-9-2-3-10-7-15-5-4-11(10)12(9)16-13(8)17-14/h2-7H,14H2,1H3,(H,16,17).
What are the key properties of (3-methyl-1,8-phenanthrolin-2-yl)hydrazine?
(3-methyl-1,8-phenanthrolin-2-yl)hydrazine has a molecular weight of 224.27 g/mol, XLogP of 2.38, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-1,8-phenanthrolin-2-yl)hydrazine is sourced from PubChem (CID 63232790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).