[1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine

C12H13ClN4 — CID 105253061

IUPAC[1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine
SMILESNNC(Cc1cccnc1)c1ccc(Cl)nc1
InChIInChI=1S/C12H13ClN4/c13-12-4-3-10(8-16-12)11(17-14)6-9-2-1-5-15-7-9/h1-5,7-8,11,17H,6,14H2
InChIKeyJETNURYHNNYROG-UHFFFAOYSA-N
MW248.72 g/mol
LogP1.88
Rot. Bonds4

About [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine

[1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine (PubChem CID 105253061) has the molecular formula C12H13ClN4 and a molecular weight of 248.72 g/mol. Its IUPAC name is [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine.

Molecular Properties

Compound Name[1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine
PubChem CID105253061
Molecular FormulaC12H13ClN4
Molecular Weight248.72 g/mol
Exact Mass248.08
IUPAC Name[1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine
SMILESNNC(Cc1cccnc1)c1ccc(Cl)nc1
InChIInChI=1S/C12H13ClN4/c13-12-4-3-10(8-16-12)11(17-14)6-9-2-1-5-15-7-9/h1-5,7-8,11,17H,6,14H2
InChIKeyJETNURYHNNYROG-UHFFFAOYSA-N
XLogP1.88
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.72
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(4-bromo-3-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine
CID 105333727
[1-(6-chloro-3-pyridinyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine
CID 105252947
[1-(4-methylsulfonylphenyl)-2-pyridin-3-ylethyl]hydrazine
CID 105333643
[1-(6-chloro-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105253088
5-chloro-3-(1-hydrazinyl-2-pyridin-3-ylethyl)pyridin-2-amine
CID 105212191
(2-pyridin-3-yl-1-pyrimidin-4-ylethyl)hydrazine
CID 105221030
[1-(5-methylpyrimidin-2-yl)-2-pyridin-3-ylethyl]hydrazine
CID 105261546
[1-(6-chloro-3-pyridinyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105253076
[1-[3-fluoro-4-(trifluoromethyl)phenyl]-2-pyridin-3-ylethyl]hydrazine
CID 107292272
[1-(4-cyclopropyloxyphenyl)-2-pyridin-3-ylethyl]hydrazine
CID 105212080
[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-pyridin-3-ylethyl]hydrazine
CID 105212034
[2-(2,6-dichlorophenyl)-1-pyridin-3-ylethyl]hydrazine
CID 105196072

Frequently Asked Questions

What is the IUPAC name of [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine?
The IUPAC name of [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine (CID 105253061) is [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine.
What is the SMILES notation for [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine?
The canonical SMILES for [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine is NNC(Cc1cccnc1)c1ccc(Cl)nc1.
What is the InChIKey of [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine?
The InChIKey is JETNURYHNNYROG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN4/c13-12-4-3-10(8-16-12)11(17-14)6-9-2-1-5-15-7-9/h1-5,7-8,11,17H,6,14H2.
What are the key properties of [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine?
[1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine has a molecular weight of 248.72 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine is sourced from PubChem (CID 105253061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).