(5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine

C12H14ClN3O2 — CID 62250764

IUPAC(5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine
SMILESCOc1cc(OC)c2nc(C)cc(NN)c2c1Cl
InChIInChI=1S/C12H14ClN3O2/c1-6-4-7(16-14)10-11(13)8(17-2)5-9(18-3)12(10)15-6/h4-5H,14H2,1-3H3,(H,15,16)
InChIKeyQVOAUEBIPIBIKP-UHFFFAOYSA-N
MW267.72 g/mol
LogP2.50
Rot. Bonds3

About (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine

(5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine (PubChem CID 62250764) has the molecular formula C12H14ClN3O2 and a molecular weight of 267.72 g/mol. Its IUPAC name is (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine
PubChem CID62250764
Molecular FormulaC12H14ClN3O2
Molecular Weight267.72 g/mol
Exact Mass267.08
IUPAC Name(5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine
SMILESCOc1cc(OC)c2nc(C)cc(NN)c2c1Cl
InChIInChI=1S/C12H14ClN3O2/c1-6-4-7(16-14)10-11(13)8(17-2)5-9(18-3)12(10)15-6/h4-5H,14H2,1-3H3,(H,15,16)
InChIKeyQVOAUEBIPIBIKP-UHFFFAOYSA-N
XLogP2.50
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.72
LogP ≤ 52.50
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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Related Compounds

(5-chloro-6,8-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine
CID 62250401
(8-methoxy-2,5-dimethylquinolin-4-yl)hydrazine
CID 62252641
(5,8-dichloro-2-methylquinolin-4-yl)hydrazine
CID 17039932
(5-chloro-2-methyl-8-phenoxyquinolin-4-yl)hydrazine
CID 63482977
[5-chloro-8-methoxy-2-(methoxymethyl)quinolin-4-yl]hydrazine
CID 62319205
5-chloro-2-cyclopropyl-6,8-dimethoxyquinolin-4-amine
CID 63357745
(5,8-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine
CID 55050910
(5-fluoro-2,8-dimethylquinolin-4-yl)hydrazine
CID 62250422
(8-fluoro-2,5-dimethylquinolin-4-yl)hydrazine
CID 62252255
[2-(difluoromethyl)-8-methoxy-5-methylquinolin-4-yl]hydrazine
CID 62890904
[2-(difluoromethyl)-5,8-dimethoxyquinolin-4-yl]hydrazine
CID 62892113
[5,8-dimethoxy-2-(trifluoromethyl)quinolin-4-yl]hydrazine
CID 62251152

Frequently Asked Questions

What is the IUPAC name of (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine?
The IUPAC name of (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine (CID 62250764) is (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine.
What is the SMILES notation for (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine?
The canonical SMILES for (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine is COc1cc(OC)c2nc(C)cc(NN)c2c1Cl.
What is the InChIKey of (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine?
The InChIKey is QVOAUEBIPIBIKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN3O2/c1-6-4-7(16-14)10-11(13)8(17-2)5-9(18-3)12(10)15-6/h4-5H,14H2,1-3H3,(H,15,16).
What are the key properties of (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine?
(5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine has a molecular weight of 267.72 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-6,8-dimethoxy-2-methylquinolin-4-yl)hydrazine is sourced from PubChem (CID 62250764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).