[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine

C17H18N4 — CID 103129783

IUPAC[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine
SMILESNNC(CC1Cc2ccccc21)c1cnn2ccccc12
InChIInChI=1S/C17H18N4/c18-20-16(10-13-9-12-5-1-2-6-14(12)13)15-11-19-21-8-4-3-7-17(15)21/h1-8,11,13,16,20H,9-10,18H2
InChIKeyLBYJREDZIUCNBV-UHFFFAOYSA-N
MW278.36 g/mol
LogP2.57
Rot. Bonds4

About [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine

[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine (PubChem CID 103129783) has the molecular formula C17H18N4 and a molecular weight of 278.36 g/mol. Its IUPAC name is [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine
PubChem CID103129783
Molecular FormulaC17H18N4
Molecular Weight278.36 g/mol
Exact Mass278.15
IUPAC Name[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine
SMILESNNC(CC1Cc2ccccc21)c1cnn2ccccc12
InChIInChI=1S/C17H18N4/c18-20-16(10-13-9-12-5-1-2-6-14(12)13)15-11-19-21-8-4-3-7-17(15)21/h1-8,11,13,16,20H,9-10,18H2
InChIKeyLBYJREDZIUCNBV-UHFFFAOYSA-N
XLogP2.57
TPSA55.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-cyclohexyl-1-pyrazolo[1,5-a]pyridin-3-ylethyl)hydrazine
CID 103129550
1-pyrazolo[1,5-a]pyridin-3-ylbutylhydrazine
CID 103129377
[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203771
(3-methyl-1-pyrazolo[1,5-a]pyridin-3-ylpentyl)hydrazine
CID 103129571
1-pyrazolo[1,5-a]pyridin-3-ylhexylhydrazine
CID 103129533
[2-(2-chlorophenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine
CID 103129443
[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-(2,4-dimethylphenyl)ethyl]hydrazine
CID 105319301
[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine
CID 114022357
[1-pyrazolo[1,5-a]pyridin-3-yl-2-(1,3-thiazol-5-yl)ethyl]hydrazine
CID 103129907
2-[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-hydrazinylethyl]-4-bromoaniline
CID 105263584
[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-(3,4-dichlorophenyl)ethyl]hydrazine
CID 105257179
[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-(3,5-dibromophenyl)ethyl]hydrazine
CID 107979238

Frequently Asked Questions

What is the IUPAC name of [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine?
The IUPAC name of [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine (CID 103129783) is [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine.
What is the SMILES notation for [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine?
The canonical SMILES for [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine is NNC(CC1Cc2ccccc21)c1cnn2ccccc12.
What is the InChIKey of [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine?
The InChIKey is LBYJREDZIUCNBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4/c18-20-16(10-13-9-12-5-1-2-6-14(12)13)15-11-19-21-8-4-3-7-17(15)21/h1-8,11,13,16,20H,9-10,18H2.
What are the key properties of [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine?
[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine has a molecular weight of 278.36 g/mol, XLogP of 2.57, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine is sourced from PubChem (CID 103129783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).