[1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine

C15H18ClN3 — CID 105287759

IUPAC[1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1ccc(C)c(CC(NN)c2ccncc2Cl)c1
InChIInChI=1S/C15H18ClN3/c1-10-3-4-11(2)12(7-10)8-15(19-17)13-5-6-18-9-14(13)16/h3-7,9,15,19H,8,17H2,1-2H3
InChIKeyNLDJYZQYRMECLR-UHFFFAOYSA-N
MW275.78 g/mol
LogP3.10
Rot. Bonds4

About [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine

[1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine (PubChem CID 105287759) has the molecular formula C15H18ClN3 and a molecular weight of 275.78 g/mol. Its IUPAC name is [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
PubChem CID105287759
Molecular FormulaC15H18ClN3
Molecular Weight275.78 g/mol
Exact Mass275.12
IUPAC Name[1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1ccc(C)c(CC(NN)c2ccncc2Cl)c1
InChIInChI=1S/C15H18ClN3/c1-10-3-4-11(2)12(7-10)8-15(19-17)13-5-6-18-9-14(13)16/h3-7,9,15,19H,8,17H2,1-2H3
InChIKeyNLDJYZQYRMECLR-UHFFFAOYSA-N
XLogP3.10
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.78
LogP ≤ 53.10
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 [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine (CID 105287759) is [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine is Cc1ccc(C)c(CC(NN)c2ccncc2Cl)c1.
What is the InChIKey of [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine?
The InChIKey is NLDJYZQYRMECLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3/c1-10-3-4-11(2)12(7-10)8-15(19-17)13-5-6-18-9-14(13)16/h3-7,9,15,19H,8,17H2,1-2H3.
What are the key properties of [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine?
[1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine has a molecular weight of 275.78 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105287759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).