[(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine

C12H17ClN2O — CID 105306666

IUPAC[(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
SMILESCc1ccc(Cl)cc1C(NN)C1CCOC1
InChIInChI=1S/C12H17ClN2O/c1-8-2-3-10(13)6-11(8)12(15-14)9-4-5-16-7-9/h2-3,6,9,12,15H,4-5,7,14H2,1H3
InChIKeyNAEKHHAMFPBVDY-UHFFFAOYSA-N
MW240.73 g/mol
LogP2.19
Rot. Bonds3

About [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine

[(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine (PubChem CID 105306666) has the molecular formula C12H17ClN2O and a molecular weight of 240.73 g/mol. Its IUPAC name is [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
PubChem CID105306666
Molecular FormulaC12H17ClN2O
Molecular Weight240.73 g/mol
Exact Mass240.10
IUPAC Name[(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
SMILESCc1ccc(Cl)cc1C(NN)C1CCOC1
InChIInChI=1S/C12H17ClN2O/c1-8-2-3-10(13)6-11(8)12(15-14)9-4-5-16-7-9/h2-3,6,9,12,15H,4-5,7,14H2,1H3
InChIKeyNAEKHHAMFPBVDY-UHFFFAOYSA-N
XLogP2.19
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 52.19
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

1-(5-chloro-2-methylphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 115856559
[(5-chloro-2-fluorophenyl)-(oxan-3-yl)methyl]hydrazine
CID 107139728
[(2,4-dimethylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105229339
[(5-bromo-2-methylphenyl)-(oxan-3-yl)methyl]hydrazine
CID 107139910
[(5-chloro-2-methylphenyl)-(3,4-dimethylcyclohexyl)methyl]hydrazine
CID 105312511
[(5-fluoro-2-methylphenyl)-(oxan-4-yl)methyl]hydrazine
CID 105211548
[(2-bromo-5-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105306637
[(2-chloro-3-fluorophenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105306562
[(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine
CID 105229812
N-[(2,5-dichlorophenyl)-(oxolan-3-yl)methyl]ethanamine
CID 61276511
[(2-methoxy-4-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 106793716
[(2-fluoro-4,6-dimethylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 106884319

Frequently Asked Questions

What is the IUPAC name of [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine?
The IUPAC name of [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine (CID 105306666) is [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine?
The canonical SMILES for [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine is Cc1ccc(Cl)cc1C(NN)C1CCOC1.
What is the InChIKey of [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine?
The InChIKey is NAEKHHAMFPBVDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O/c1-8-2-3-10(13)6-11(8)12(15-14)9-4-5-16-7-9/h2-3,6,9,12,15H,4-5,7,14H2,1H3.
What are the key properties of [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine?
[(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine has a molecular weight of 240.73 g/mol, XLogP of 2.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105306666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).