[1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine

C13H18N4O — CID 105191715

IUPAC[1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
SMILESCOc1cccc(C(Cc2cnn(C)c2)NN)c1
InChIInChI=1S/C13H18N4O/c1-17-9-10(8-15-17)6-13(16-14)11-4-3-5-12(7-11)18-2/h3-5,7-9,13,16H,6,14H2,1-2H3
InChIKeyANFMKVLEHASGJJ-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.18
Rot. Bonds5

About [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine

[1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 105191715) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
PubChem CID105191715
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name[1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
SMILESCOc1cccc(C(Cc2cnn(C)c2)NN)c1
InChIInChI=1S/C13H18N4O/c1-17-9-10(8-15-17)6-13(16-14)11-4-3-5-12(7-11)18-2/h3-5,7-9,13,16H,6,14H2,1-2H3
InChIKeyANFMKVLEHASGJJ-UHFFFAOYSA-N
XLogP1.18
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

1,2-bis(1-methylpyrazol-4-yl)ethylhydrazine
CID 105228414
1-(3-methoxyphenyl)-N-[(1-methylpyrazol-4-yl)methyl]ethanamine
CID 60945948
(1R)-1-(3-methoxyphenyl)-N-[2-(1-methylpyrazol-4-yl)ethyl]ethanamine
CID 103001791
1-(3-methoxyphenyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]ethanol
CID 81134031
[1-(3-chloro-4-methylphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105291154
[2-(5-ethyl-2-pyridinyl)-1-(3-methoxyphenyl)ethyl]hydrazine
CID 105191623
2-[(3-methoxyphenyl)methyl]-N-methyl-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 62515952
[1-(4-bromo-3-chlorophenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105291168
[1-[3-(difluoromethoxy)phenyl]-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291323
[1-(2-methoxy-4-methylphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 106793951
[1-(3-ethoxyphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105192057
[1-(5-methylfuran-3-yl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105291170

Frequently Asked Questions

What is the IUPAC name of [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine (CID 105191715) is [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine is COc1cccc(C(Cc2cnn(C)c2)NN)c1.
What is the InChIKey of [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is ANFMKVLEHASGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-17-9-10(8-15-17)6-13(16-14)11-4-3-5-12(7-11)18-2/h3-5,7-9,13,16H,6,14H2,1-2H3.
What are the key properties of [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine?
[1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 246.31 g/mol, XLogP of 1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105191715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).