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

C11H14ClN5O — CID 105339114

IUPAC[(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCOc1cnn(C)c1C(NN)c1ccncc1Cl
InChIInChI=1S/C11H14ClN5O/c1-17-11(9(18-2)6-15-17)10(16-13)7-3-4-14-5-8(7)12/h3-6,10,16H,13H2,1-2H3
InChIKeyDBAHYQPLZPPEMG-UHFFFAOYSA-N
MW267.72 g/mol
LogP1.03
Rot. Bonds4

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

[(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine (PubChem CID 105339114) has the molecular formula C11H14ClN5O and a molecular weight of 267.72 g/mol. Its IUPAC name is [(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
PubChem CID105339114
Molecular FormulaC11H14ClN5O
Molecular Weight267.72 g/mol
Exact Mass267.09
IUPAC Name[(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCOc1cnn(C)c1C(NN)c1ccncc1Cl
InChIInChI=1S/C11H14ClN5O/c1-17-11(9(18-2)6-15-17)10(16-13)7-3-4-14-5-8(7)12/h3-6,10,16H,13H2,1-2H3
InChIKeyDBAHYQPLZPPEMG-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': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]propan-1-amine
CID 105186345
[(3-chloro-4-pyridinyl)-(2-methoxyphenyl)methyl]hydrazine
CID 105285750
[(4-chloro-3-methoxyphenyl)-(3-chloro-4-pyridinyl)methyl]hydrazine
CID 105320814
[(6-chloro-3-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105253115
[(3-bromo-2-chlorophenyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105339123
[(2,6-dimethoxyphenyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105339134
4-[hydrazinyl-(4-methoxy-1-methylpyrazol-5-yl)methyl]-N,N-dimethylaniline
CID 105339001
1-(4-methoxy-1-methylpyrazol-5-yl)ethylhydrazine
CID 105201324
N-[(3-chloro-4-pyridinyl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]propan-1-amine
CID 105186702
[(4-chlorophenyl)-(3-methoxy-4-pyridinyl)methyl]hydrazine
CID 105281225
(4-chloro-1-methylpyrazol-5-yl)-(3-methoxy-4-pyridinyl)methanol
CID 105066457
[(4-chloro-1-methylpyrazol-5-yl)-pyridin-4-ylmethyl]hydrazine
CID 105196547

Frequently Asked Questions

What is the IUPAC name of [(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The IUPAC name of [(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine (CID 105339114) is [(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine is COc1cnn(C)c1C(NN)c1ccncc1Cl.
What is the InChIKey of [(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The InChIKey is DBAHYQPLZPPEMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN5O/c1-17-11(9(18-2)6-15-17)10(16-13)7-3-4-14-5-8(7)12/h3-6,10,16H,13H2,1-2H3.
What are the key properties of [(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
[(3-chloro-4-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 [(3-chloro-4-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105339114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).