[(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine

C16H22N4O — CID 105340954

IUPAC[(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCCc1cc(C(NN)c2ccc(OC3CC3)cc2)n(C)n1
InChIInChI=1S/C16H22N4O/c1-3-12-10-15(20(2)19-12)16(18-17)11-4-6-13(7-5-11)21-14-8-9-14/h4-7,10,14,16,18H,3,8-9,17H2,1-2H3
InChIKeyNMDJXUAGNNPXOO-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.08
Rot. Bonds6

About [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine

[(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine (PubChem CID 105340954) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine
PubChem CID105340954
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC Name[(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCCc1cc(C(NN)c2ccc(OC3CC3)cc2)n(C)n1
InChIInChI=1S/C16H22N4O/c1-3-12-10-15(20(2)19-12)16(18-17)11-4-6-13(7-5-11)21-14-8-9-14/h4-7,10,14,16,18H,3,8-9,17H2,1-2H3
InChIKeyNMDJXUAGNNPXOO-UHFFFAOYSA-N
XLogP2.08
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.08
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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Frequently Asked Questions

What is the IUPAC name of [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine?
The IUPAC name of [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine (CID 105340954) is [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine is CCc1cc(C(NN)c2ccc(OC3CC3)cc2)n(C)n1.
What is the InChIKey of [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine?
The InChIKey is NMDJXUAGNNPXOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-3-12-10-15(20(2)19-12)16(18-17)11-4-6-13(7-5-11)21-14-8-9-14/h4-7,10,14,16,18H,3,8-9,17H2,1-2H3.
What are the key properties of [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine?
[(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine has a molecular weight of 286.38 g/mol, XLogP of 2.08, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-cyclopropyloxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105340954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).