[6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine

C14H12ClN5O — CID 80908989

IUPAC[6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)cc(Oc2ccc(Cl)c3cccnc23)n1
InChIInChI=1S/C14H12ClN5O/c1-8-18-12(20-16)7-13(19-8)21-11-5-4-10(15)9-3-2-6-17-14(9)11/h2-7H,16H2,1H3,(H,18,19,20)
InChIKeyUJKOQSPEDZLJQI-UHFFFAOYSA-N
MW301.74 g/mol
LogP3.06
Rot. Bonds3

About [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine

[6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine (PubChem CID 80908989) has the molecular formula C14H12ClN5O and a molecular weight of 301.74 g/mol. Its IUPAC name is [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine
PubChem CID80908989
Molecular FormulaC14H12ClN5O
Molecular Weight301.74 g/mol
Exact Mass301.07
IUPAC Name[6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)cc(Oc2ccc(Cl)c3cccnc23)n1
InChIInChI=1S/C14H12ClN5O/c1-8-18-12(20-16)7-13(19-8)21-11-5-4-10(15)9-3-2-6-17-14(9)11/h2-7H,16H2,1H3,(H,18,19,20)
InChIKeyUJKOQSPEDZLJQI-UHFFFAOYSA-N
XLogP3.06
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.74
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

6-(5-chloroquinolin-8-yl)oxy-N-ethylpyridin-2-amine
CID 80867005
2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile
CID 24701489
5-chloro-4-(5-chloroquinolin-8-yl)oxypyrimidin-2-amine
CID 80881381
1-[5-(5-chloroquinolin-8-yl)oxypyrazin-2-yl]-N-methylmethanamine
CID 107381926
[2-methyl-6-(2,3,5-trimethylphenoxy)pyrimidin-4-yl]hydrazine
CID 80916646
CID 12945983
CID 12945983
[6-(5-bromo-2-methylphenoxy)-2-methylpyrimidin-4-yl]hydrazine
CID 107287706
4-(2-chloro-4-methylphenoxy)-6-hydrazinylpyrimidin-2-amine
CID 80930868
5-bromo-4-(5-chloroquinolin-8-yl)oxy-N-methylpyrimidin-2-amine
CID 80866833
5-(5-chloroquinolin-8-yl)oxypentan-1-amine
CID 54965610
5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile
CID 60923164
ethyl 2-[(5-chloroquinolin-8-yl)oxycarbonylamino]acetate
CID 13338827

Frequently Asked Questions

What is the IUPAC name of [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine (CID 80908989) is [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine is Cc1nc(NN)cc(Oc2ccc(Cl)c3cccnc23)n1.
What is the InChIKey of [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine?
The InChIKey is UJKOQSPEDZLJQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN5O/c1-8-18-12(20-16)7-13(19-8)21-11-5-4-10(15)9-3-2-6-17-14(9)11/h2-7H,16H2,1H3,(H,18,19,20).
What are the key properties of [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine?
[6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine has a molecular weight of 301.74 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(5-chloroquinolin-8-yl)oxy-2-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80908989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).