[2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine

C13H14Cl2N4O — CID 107312811

IUPAC[2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine
SMILESCOc1cc(C(Cc2cccc(Cl)c2Cl)NN)ncn1
InChIInChI=1S/C13H14Cl2N4O/c1-20-12-6-10(17-7-18-12)11(19-16)5-8-3-2-4-9(14)13(8)15/h2-4,6-7,11,19H,5,16H2,1H3
InChIKeyFYWSCKSGFCKAJC-UHFFFAOYSA-N
MW313.19 g/mol
LogP2.54
Rot. Bonds5

About [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine

[2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine (PubChem CID 107312811) has the molecular formula C13H14Cl2N4O and a molecular weight of 313.19 g/mol. Its IUPAC name is [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine
PubChem CID107312811
Molecular FormulaC13H14Cl2N4O
Molecular Weight313.19 g/mol
Exact Mass312.05
IUPAC Name[2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine
SMILESCOc1cc(C(Cc2cccc(Cl)c2Cl)NN)ncn1
InChIInChI=1S/C13H14Cl2N4O/c1-20-12-6-10(17-7-18-12)11(19-16)5-8-3-2-4-9(14)13(8)15/h2-4,6-7,11,19H,5,16H2,1H3
InChIKeyFYWSCKSGFCKAJC-UHFFFAOYSA-N
XLogP2.54
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.19
LogP ≤ 52.54
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

[2-(5-bromo-2-methoxyphenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine
CID 102953300
[2-(5-bromo-2-fluorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine
CID 102953441
[1-(5-chloro-2-methoxyphenyl)-2-(2,3-dichlorophenyl)ethyl]hydrazine
CID 107312860
N-[(2,3-dichlorophenyl)-(6-methoxypyrimidin-4-yl)methyl]ethanamine
CID 102951699
[1-(2-bromo-5-methoxyphenyl)-2-(2,3-dichlorophenyl)ethyl]hydrazine
CID 107312937
[1-(6-methoxypyrimidin-4-yl)-4-phenylbutyl]hydrazine
CID 102953393
[2-(2,3-dichlorophenyl)-1-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 107312565
[2-cyclopropyl-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine
CID 102953246
2-(2,3-dichlorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
CID 107308299
1-(6-methoxypyrimidin-4-yl)pent-4-enylhydrazine
CID 102953290
[4-methoxy-1-(6-methoxypyrimidin-4-yl)-4-methylpentyl]hydrazine
CID 103027166
[1-(6-methoxypyrimidin-4-yl)-3-methylidenepentyl]hydrazine
CID 102953237

Frequently Asked Questions

What is the IUPAC name of [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine?
The IUPAC name of [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine (CID 107312811) is [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine is COc1cc(C(Cc2cccc(Cl)c2Cl)NN)ncn1.
What is the InChIKey of [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine?
The InChIKey is FYWSCKSGFCKAJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Cl2N4O/c1-20-12-6-10(17-7-18-12)11(19-16)5-8-3-2-4-9(14)13(8)15/h2-4,6-7,11,19H,5,16H2,1H3.
What are the key properties of [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine?
[2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine has a molecular weight of 313.19 g/mol, XLogP of 2.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,3-dichlorophenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine is sourced from PubChem (CID 107312811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).