1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine

C17H28N2 — CID 105319320

IUPAC1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine
SMILESCCCCCCCC(CC1Cc2ccccc21)NN
InChIInChI=1S/C17H28N2/c1-2-3-4-5-6-10-16(19-18)13-15-12-14-9-7-8-11-17(14)15/h7-9,11,15-16,19H,2-6,10,12-13,18H2,1H3
InChIKeyNHTFHWAHWYEYPK-UHFFFAOYSA-N
MW260.42 g/mol
LogP3.91
Rot. Bonds9

About 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine

1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine (PubChem CID 105319320) has the molecular formula C17H28N2 and a molecular weight of 260.42 g/mol. Its IUPAC name is 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine.

Molecular Properties

Compound Name1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine
PubChem CID105319320
Molecular FormulaC17H28N2
Molecular Weight260.42 g/mol
Exact Mass260.23
IUPAC Name1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine
SMILESCCCCCCCC(CC1Cc2ccccc21)NN
InChIInChI=1S/C17H28N2/c1-2-3-4-5-6-10-16(19-18)13-15-12-14-9-7-8-11-17(14)15/h7-9,11,15-16,19H,2-6,10,12-13,18H2,1H3
InChIKeyNHTFHWAHWYEYPK-UHFFFAOYSA-N
XLogP3.91
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)hexan-2-amine
CID 79413170
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-4-phenylbutan-2-yl]hydrazine
CID 105205768
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-ethylheptan-2-yl]hydrazine
CID 105319335
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-4-phenoxybutan-2-yl]hydrazine
CID 105191501
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170643
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)propan-2-ylhydrazine
CID 105201338
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-4-methoxypentan-2-yl]hydrazine
CID 105267173
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-4-(furan-2-yl)butan-2-yl]hydrazine
CID 105319294
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-(3,5-dimethylphenyl)propan-2-yl]hydrazine
CID 105212720
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-ethylpentan-2-yl]hydrazine
CID 105319265
N-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)heptan-2-amine
CID 115812394
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine
CID 105198387

Frequently Asked Questions

What is the IUPAC name of 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine?
The IUPAC name of 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine (CID 105319320) is 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine.
What is the SMILES notation for 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine?
The canonical SMILES for 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine is CCCCCCCC(CC1Cc2ccccc21)NN.
What is the InChIKey of 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine?
The InChIKey is NHTFHWAHWYEYPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-2-3-4-5-6-10-16(19-18)13-15-12-14-9-7-8-11-17(14)15/h7-9,11,15-16,19H,2-6,10,12-13,18H2,1H3.
What are the key properties of 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine?
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine has a molecular weight of 260.42 g/mol, XLogP of 3.91, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)nonan-2-ylhydrazine is sourced from PubChem (CID 105319320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).