(5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride

C16H15Cl2N3 — CID 43866151

IUPAC(5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride
SMILESCc1ccc(Cl)c2cc(-c3ccccc3)c(NN)nc12.Cl
InChIInChI=1S/C16H14ClN3.ClH/c1-10-7-8-14(17)13-9-12(11-5-3-2-4-6-11)16(20-18)19-15(10)13;/h2-9H,18H2,1H3,(H,19,20);1H
InChIKeyGVPHHKNYSHJPGB-UHFFFAOYSA-N
MW320.22 g/mol
LogP4.57
Rot. Bonds2

About (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride

(5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride (PubChem CID 43866151) has the molecular formula C16H15Cl2N3 and a molecular weight of 320.22 g/mol. Its IUPAC name is (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride.

Molecular Properties

Compound Name(5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride
PubChem CID43866151
Molecular FormulaC16H15Cl2N3
Molecular Weight320.22 g/mol
Exact Mass319.06
IUPAC Name(5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride
SMILESCc1ccc(Cl)c2cc(-c3ccccc3)c(NN)nc12.Cl
InChIInChI=1S/C16H14ClN3.ClH/c1-10-7-8-14(17)13-9-12(11-5-3-2-4-6-11)16(20-18)19-15(10)13;/h2-9H,18H2,1H3,(H,19,20);1H
InChIKeyGVPHHKNYSHJPGB-UHFFFAOYSA-N
XLogP4.57
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.22
LogP ≤ 54.57
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 (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride?
The IUPAC name of (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride (CID 43866151) is (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride.
What is the SMILES notation for (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride?
The canonical SMILES for (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride is Cc1ccc(Cl)c2cc(-c3ccccc3)c(NN)nc12.Cl.
What is the InChIKey of (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride?
The InChIKey is GVPHHKNYSHJPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3.ClH/c1-10-7-8-14(17)13-9-12(11-5-3-2-4-6-11)16(20-18)19-15(10)13;/h2-9H,18H2,1H3,(H,19,20);1H.
What are the key properties of (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride?
(5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride has a molecular weight of 320.22 g/mol, XLogP of 4.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-8-methyl-3-phenylquinolin-2-yl)hydrazine;hydrochloride is sourced from PubChem (CID 43866151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).