[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine

C13H18ClN5O — CID 105334017

IUPAC[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
SMILESCOc1ncccc1C(Cc1c(C)nn(C)c1Cl)NN
InChIInChI=1S/C13H18ClN5O/c1-8-10(12(14)19(2)18-8)7-11(17-15)9-5-4-6-16-13(9)20-3/h4-6,11,17H,7,15H2,1-3H3
InChIKeyPJHUQZDBAQPYSQ-UHFFFAOYSA-N
MW295.77 g/mol
LogP1.53
Rot. Bonds5

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

[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine (PubChem CID 105334017) has the molecular formula C13H18ClN5O and a molecular weight of 295.77 g/mol. Its IUPAC name is [2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
PubChem CID105334017
Molecular FormulaC13H18ClN5O
Molecular Weight295.77 g/mol
Exact Mass295.12
IUPAC Name[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
SMILESCOc1ncccc1C(Cc1c(C)nn(C)c1Cl)NN
InChIInChI=1S/C13H18ClN5O/c1-8-10(12(14)19(2)18-8)7-11(17-15)9-5-4-6-16-13(9)20-3/h4-6,11,17H,7,15H2,1-3H3
InChIKeyPJHUQZDBAQPYSQ-UHFFFAOYSA-N
XLogP1.53
TPSA77.99 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.77
LogP ≤ 51.53
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

2-(5-chloro-1,3-dimethylpyrazol-4-yl)-N-methyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105180268
[2-(2,5-dimethylpyrazol-3-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105315774
[2-(2,6-difluorophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105342854
1-(2-methoxy-3-pyridinyl)propylhydrazine
CID 105281861
[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105258240
[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(3,6-dimethylpyridazin-4-yl)ethyl]hydrazine
CID 105334091
[2-(furan-3-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105331770
[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine
CID 107970575
1-(2-amino-3-methoxyphenyl)-2-(5-chloro-1,3-dimethylpyrazol-4-yl)ethanol
CID 107469558
[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105228861
[1-(2-methoxy-3-pyridinyl)-2-thiophen-2-ylethyl]hydrazine
CID 105295492
2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethanone
CID 105128260

Frequently Asked Questions

What is the IUPAC name of [2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine (CID 105334017) is [2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine is COc1ncccc1C(Cc1c(C)nn(C)c1Cl)NN.
What is the InChIKey of [2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine?
The InChIKey is PJHUQZDBAQPYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN5O/c1-8-10(12(14)19(2)18-8)7-11(17-15)9-5-4-6-16-13(9)20-3/h4-6,11,17H,7,15H2,1-3H3.
What are the key properties of [2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine?
[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine has a molecular weight of 295.77 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105334017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).