[2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine

C18H19N3 — CID 105208945

IUPAC[2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine
SMILESCc1cccc(CC(NN)c2cnc3ccccc3c2)c1
InChIInChI=1S/C18H19N3/c1-13-5-4-6-14(9-13)10-18(21-19)16-11-15-7-2-3-8-17(15)20-12-16/h2-9,11-12,18,21H,10,19H2,1H3
InChIKeyBWYVIAJDIVZTJO-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.29
Rot. Bonds4

About [2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine

[2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine (PubChem CID 105208945) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is [2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine
PubChem CID105208945
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name[2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine
SMILESCc1cccc(CC(NN)c2cnc3ccccc3c2)c1
InChIInChI=1S/C18H19N3/c1-13-5-4-6-14(9-13)10-18(21-19)16-11-15-7-2-3-8-17(15)20-12-16/h2-9,11-12,18,21H,10,19H2,1H3
InChIKeyBWYVIAJDIVZTJO-UHFFFAOYSA-N
XLogP3.29
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.29
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-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine?
The IUPAC name of [2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine (CID 105208945) is [2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine.
What is the SMILES notation for [2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine?
The canonical SMILES for [2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine is Cc1cccc(CC(NN)c2cnc3ccccc3c2)c1.
What is the InChIKey of [2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine?
The InChIKey is BWYVIAJDIVZTJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-13-5-4-6-14(9-13)10-18(21-19)16-11-15-7-2-3-8-17(15)20-12-16/h2-9,11-12,18,21H,10,19H2,1H3.
What are the key properties of [2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine?
[2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine has a molecular weight of 277.37 g/mol, XLogP of 3.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine is sourced from PubChem (CID 105208945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).