[(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine

C18H19N3 — CID 105304674

IUPAC[(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2cccc3cccnc23)c(C)c1
InChIInChI=1S/C18H19N3/c1-12-8-9-15(13(2)11-12)18(21-19)16-7-3-5-14-6-4-10-20-17(14)16/h3-11,18,21H,19H2,1-2H3
InChIKeySVUXJSKDNXESHD-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.40
Rot. Bonds3

About [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine

[(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine (PubChem CID 105304674) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine
PubChem CID105304674
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name[(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2cccc3cccnc23)c(C)c1
InChIInChI=1S/C18H19N3/c1-12-8-9-15(13(2)11-12)18(21-19)16-7-3-5-14-6-4-10-20-17(14)16/h3-11,18,21H,19H2,1-2H3
InChIKeySVUXJSKDNXESHD-UHFFFAOYSA-N
XLogP3.40
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine?
The IUPAC name of [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine (CID 105304674) is [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine.
What is the SMILES notation for [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine?
The canonical SMILES for [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine is Cc1ccc(C(NN)c2cccc3cccnc23)c(C)c1.
What is the InChIKey of [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine?
The InChIKey is SVUXJSKDNXESHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-12-8-9-15(13(2)11-12)18(21-19)16-7-3-5-14-6-4-10-20-17(14)16/h3-11,18,21H,19H2,1-2H3.
What are the key properties of [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine?
[(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine has a molecular weight of 277.37 g/mol, XLogP of 3.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine is sourced from PubChem (CID 105304674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).