[cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine

C16H24N2 — CID 106650270

IUPAC[cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine
SMILESCCc1ccccc1C(NN)C1=CCCCCC1
InChIInChI=1S/C16H24N2/c1-2-13-9-7-8-12-15(13)16(18-17)14-10-5-3-4-6-11-14/h7-10,12,16,18H,2-6,11,17H2,1H3
InChIKeyRVPXTUIZHXWSQX-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.64
Rot. Bonds4

About [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine

[cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine (PubChem CID 106650270) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine
PubChem CID106650270
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name[cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine
SMILESCCc1ccccc1C(NN)C1=CCCCCC1
InChIInChI=1S/C16H24N2/c1-2-13-9-7-8-12-15(13)16(18-17)14-10-5-3-4-6-11-14/h7-10,12,16,18H,2-6,11,17H2,1H3
InChIKeyRVPXTUIZHXWSQX-UHFFFAOYSA-N
XLogP3.64
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine?
The IUPAC name of [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine (CID 106650270) is [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine.
What is the SMILES notation for [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine?
The canonical SMILES for [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine is CCc1ccccc1C(NN)C1=CCCCCC1.
What is the InChIKey of [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine?
The InChIKey is RVPXTUIZHXWSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-2-13-9-7-8-12-15(13)16(18-17)14-10-5-3-4-6-11-14/h7-10,12,16,18H,2-6,11,17H2,1H3.
What are the key properties of [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine?
[cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine has a molecular weight of 244.38 g/mol, XLogP of 3.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohepten-1-yl-(2-ethylphenyl)methyl]hydrazine is sourced from PubChem (CID 106650270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).