[(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine

C18H30N2O — CID 105278518

IUPAC[(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine
SMILESCCOC1(C(NN)c2cc(C)cc(C)c2)CCCCCC1
InChIInChI=1S/C18H30N2O/c1-4-21-18(9-7-5-6-8-10-18)17(20-19)16-12-14(2)11-15(3)13-16/h11-13,17,20H,4-10,19H2,1-3H3
InChIKeyPZMGTQUYAKKMQF-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.94
Rot. Bonds5

About [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine

[(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine (PubChem CID 105278518) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine
PubChem CID105278518
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name[(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine
SMILESCCOC1(C(NN)c2cc(C)cc(C)c2)CCCCCC1
InChIInChI=1S/C18H30N2O/c1-4-21-18(9-7-5-6-8-10-18)17(20-19)16-12-14(2)11-15(3)13-16/h11-13,17,20H,4-10,19H2,1-3H3
InChIKeyPZMGTQUYAKKMQF-UHFFFAOYSA-N
XLogP3.94
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[(3,5-dimethylphenyl)-(1-methoxycyclopentyl)methyl]hydrazine
CID 105268838
[(1-ethoxycyclopentyl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105275848
[2-(3,5-dimethylphenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105276272
(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methanol
CID 116756160
[(1-ethoxycyclohexyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 107130905
[(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine
CID 105276324
[(3,5-dimethylphenyl)-(1-ethylcyclopentyl)methyl]hydrazine
CID 105286762
[(3,4-difluorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine
CID 105275720
[(1-ethoxycycloheptyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105278498
[(3-fluoro-5-methylphenyl)-(1-methoxycyclohexyl)methyl]hydrazine
CID 105276174
[(1-ethoxycycloheptyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine
CID 105278412
[(1-ethoxycycloheptyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105278414

Frequently Asked Questions

What is the IUPAC name of [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine?
The IUPAC name of [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine (CID 105278518) is [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine?
The canonical SMILES for [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine is CCOC1(C(NN)c2cc(C)cc(C)c2)CCCCCC1.
What is the InChIKey of [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine?
The InChIKey is PZMGTQUYAKKMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-4-21-18(9-7-5-6-8-10-18)17(20-19)16-12-14(2)11-15(3)13-16/h11-13,17,20H,4-10,19H2,1-3H3.
What are the key properties of [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine?
[(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine has a molecular weight of 290.45 g/mol, XLogP of 3.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine is sourced from PubChem (CID 105278518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).