[1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine

C18H28N2 — CID 106650129

IUPAC[1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine
SMILESCc1cccc(CCC(NN)/C2=C/CCCCCC2)c1
InChIInChI=1S/C18H28N2/c1-15-8-7-9-16(14-15)12-13-18(20-19)17-10-5-3-2-4-6-11-17/h7-10,14,18,20H,2-6,11-13,19H2,1H3/b17-10+
InChIKeyURUCWXHDHVWQCH-LICLKQGHSA-N
MW272.44 g/mol
LogP4.04
Rot. Bonds5

About [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine

[1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine (PubChem CID 106650129) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine.

Molecular Properties

Compound Name[1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine
PubChem CID106650129
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name[1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine
SMILESCc1cccc(CCC(NN)/C2=C/CCCCCC2)c1
InChIInChI=1S/C18H28N2/c1-15-8-7-9-16(14-15)12-13-18(20-19)17-10-5-3-2-4-6-11-17/h7-10,14,18,20H,2-6,11-13,19H2,1H3/b17-10+
InChIKeyURUCWXHDHVWQCH-LICLKQGHSA-N
XLogP4.04
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 54.04
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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Related Compounds

[1-(cyclohepten-1-yl)-3-(4-methylphenyl)propyl]hydrazine
CID 106650193
[1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine
CID 106650430
1-[(1E)-cycloocten-1-yl]-N-methyl-2-(3-methylphenyl)ethanamine
CID 106652697
[cyclohepten-1-yl-(3-methylphenyl)methyl]hydrazine
CID 106648636
[1-(cyclohexen-1-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 106648692
[1-[(1E)-cycloocten-1-yl]-2-(2,6-dichlorophenyl)ethyl]hydrazine
CID 106648752
[2-(4-chlorophenyl)-1-[(1E)-cycloocten-1-yl]ethyl]hydrazine
CID 106648598
1-(cycloocten-1-yl)nonylhydrazine
CID 106649991
[1-cyclohexyl-3-(3-methylphenyl)propyl]hydrazine
CID 105282141
[1-(cycloocten-1-yl)-3-ethoxypropyl]hydrazine
CID 106650004
[1-(cyclohepten-1-yl)-4-methoxybutyl]hydrazine
CID 106648972
[1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine
CID 106648982

Frequently Asked Questions

What is the IUPAC name of [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine?
The IUPAC name of [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine (CID 106650129) is [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine.
What is the SMILES notation for [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine?
The canonical SMILES for [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine is Cc1cccc(CCC(NN)/C2=C/CCCCCC2)c1.
What is the InChIKey of [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine?
The InChIKey is URUCWXHDHVWQCH-LICLKQGHSA-N. The full InChI is InChI=1S/C18H28N2/c1-15-8-7-9-16(14-15)12-13-18(20-19)17-10-5-3-2-4-6-11-17/h7-10,14,18,20H,2-6,11-13,19H2,1H3/b17-10+.
What are the key properties of [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine?
[1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine has a molecular weight of 272.44 g/mol, XLogP of 4.04, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine is sourced from PubChem (CID 106650129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).