[2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine

C14H21ClN2O — CID 106868654

IUPAC[2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)C2CCCCO2)c(Cl)c1
InChIInChI=1S/C14H21ClN2O/c1-10-5-6-11(12(15)8-10)9-13(17-16)14-4-2-3-7-18-14/h5-6,8,13-14,17H,2-4,7,9,16H2,1H3
InChIKeyZWEUQQIWDFLFLO-UHFFFAOYSA-N
MW268.79 g/mol
LogP2.59
Rot. Bonds4

About [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine

[2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine (PubChem CID 106868654) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine
PubChem CID106868654
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC Name[2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)C2CCCCO2)c(Cl)c1
InChIInChI=1S/C14H21ClN2O/c1-10-5-6-11(12(15)8-10)9-13(17-16)14-4-2-3-7-18-14/h5-6,8,13-14,17H,2-4,7,9,16H2,1H3
InChIKeyZWEUQQIWDFLFLO-UHFFFAOYSA-N
XLogP2.59
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 52.59
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

2-(2-chloro-4-methylphenyl)-N-ethyl-1-(oxan-2-yl)ethanamine
CID 106866575
[2-(2-chloro-4-methylphenyl)-1-(oxan-4-yl)ethyl]hydrazine
CID 106868666
[2-(2-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine
CID 105285184
1-(2-chloro-4-methylphenyl)-3-(oxan-2-yl)propan-2-amine
CID 106866342
2-(2-chloro-4-methylphenyl)-1-cyclobutyl-N-methylethanamine
CID 106866254
2-(2-chloro-4-methylphenyl)-1-cyclopentylethanamine
CID 106866447
2-(2-chloro-4-methylphenyl)-1-cyclohexylethanamine
CID 106866830
1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine
CID 106868414
[(2-fluoro-5-methylphenyl)-(oxan-2-yl)methyl]hydrazine
CID 105302766
[2-(5-bromo-2,3-dihydro-1-benzofuran-7-yl)-1-(oxan-2-yl)ethyl]hydrazine
CID 105332489
[2-(furan-3-yl)-1-(oxan-2-yl)ethyl]hydrazine
CID 105331757
[2-(4-bromo-2-chlorophenyl)-1-cyclohexylethyl]hydrazine
CID 105201861

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine (CID 106868654) is [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine is Cc1ccc(CC(NN)C2CCCCO2)c(Cl)c1.
What is the InChIKey of [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine?
The InChIKey is ZWEUQQIWDFLFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O/c1-10-5-6-11(12(15)8-10)9-13(17-16)14-4-2-3-7-18-14/h5-6,8,13-14,17H,2-4,7,9,16H2,1H3.
What are the key properties of [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine?
[2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine has a molecular weight of 268.79 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chloro-4-methylphenyl)-1-(oxan-2-yl)ethyl]hydrazine is sourced from PubChem (CID 106868654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).