[(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine

C11H14ClN5O — CID 105253115

IUPAC[(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCOc1cnn(C)c1C(NN)c1ccc(Cl)nc1
InChIInChI=1S/C11H14ClN5O/c1-17-11(8(18-2)6-15-17)10(16-13)7-3-4-9(12)14-5-7/h3-6,10,16H,13H2,1-2H3
InChIKeyFOUMLKSDUHEIBW-UHFFFAOYSA-N
MW267.72 g/mol
LogP1.03
Rot. Bonds4

About [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine

[(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine (PubChem CID 105253115) has the molecular formula C11H14ClN5O and a molecular weight of 267.72 g/mol. Its IUPAC name is [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
PubChem CID105253115
Molecular FormulaC11H14ClN5O
Molecular Weight267.72 g/mol
Exact Mass267.09
IUPAC Name[(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCOc1cnn(C)c1C(NN)c1ccc(Cl)nc1
InChIInChI=1S/C11H14ClN5O/c1-17-11(8(18-2)6-15-17)10(16-13)7-3-4-9(12)14-5-7/h3-6,10,16H,13H2,1-2H3
InChIKeyFOUMLKSDUHEIBW-UHFFFAOYSA-N
XLogP1.03
TPSA77.99 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.72
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

4-[hydrazinyl-(4-methoxy-1-methylpyrazol-5-yl)methyl]-N,N-dimethylaniline
CID 105339001
[(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105339114
[(2,6-dimethoxyphenyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105339134
1-(4-methoxy-1-methylpyrazol-5-yl)ethylhydrazine
CID 105201324
[(3-bromo-2-chlorophenyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105339123
[(3-ethoxyphenyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105192015
1-(4-methoxy-1-methylpyrazol-5-yl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine
CID 114646478
N-[(4-chlorophenyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]ethanamine
CID 114646379
1-(4-chloro-3-methylphenyl)-1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylmethanamine
CID 105047226
[(3,4-dichlorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105257120
[(2-chloro-4-pyridinyl)-(4-methoxy-1-propan-2-ylpyrazol-5-yl)methyl]hydrazine
CID 105252746
(4-methoxy-1-methylpyrazol-5-yl)-(4-propan-2-ylphenyl)methanamine
CID 114646467

Frequently Asked Questions

What is the IUPAC name of [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The IUPAC name of [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine (CID 105253115) is [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine is COc1cnn(C)c1C(NN)c1ccc(Cl)nc1.
What is the InChIKey of [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The InChIKey is FOUMLKSDUHEIBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN5O/c1-17-11(8(18-2)6-15-17)10(16-13)7-3-4-9(12)14-5-7/h3-6,10,16H,13H2,1-2H3.
What are the key properties of [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
[(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine has a molecular weight of 267.72 g/mol, XLogP of 1.03, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105253115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).