[1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine

C15H24N2O — CID 105294298

IUPAC[1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine
SMILESCC(C)CCC(NN)C1OCCc2ccccc21
InChIInChI=1S/C15H24N2O/c1-11(2)7-8-14(17-16)15-13-6-4-3-5-12(13)9-10-18-15/h3-6,11,14-15,17H,7-10,16H2,1-2H3
InChIKeyCWKVHIIOUFTIMR-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.57
Rot. Bonds5

About [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine

[1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine (PubChem CID 105294298) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine
PubChem CID105294298
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name[1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine
SMILESCC(C)CCC(NN)C1OCCc2ccccc21
InChIInChI=1S/C15H24N2O/c1-11(2)7-8-14(17-16)15-13-6-4-3-5-12(13)9-10-18-15/h3-6,11,14-15,17H,7-10,16H2,1-2H3
InChIKeyCWKVHIIOUFTIMR-UHFFFAOYSA-N
XLogP2.57
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.57
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-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine
CID 105293861
1-(3,4-dihydro-1H-isochromen-1-yl)hex-5-ynylhydrazine
CID 105333523
[1-(3,4-dihydro-1H-isochromen-1-yl)-2-ethoxyethyl]hydrazine
CID 105321323
1-(3,4-dihydro-1H-isochromen-1-yl)but-3-enylhydrazine
CID 105289693
[1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine
CID 105284785
1-(3,4-dihydro-1H-isochromen-1-yl)-N-ethylethanamine
CID 12536020
1-(3,4-dihydro-1H-isochromen-1-yl)-4,4-dimethylpentan-1-amine
CID 105139926
(1R)-1-[(1R)-3,4-dihydro-1H-isochromen-1-yl]propan-1-amine
CID 919561
1-(3,4-dihydro-1H-isochromen-1-yl)propan-1-amine
CID 546897
[1-(2,3-dihydro-1H-inden-2-yl)-4-methylpentyl]hydrazine
CID 105234070
1-(3,4-dihydro-1H-isochromen-1-yl)-N,3-dimethylbut-3-en-1-amine
CID 105162904
1-(3,4-dihydro-1H-isochromen-1-yl)-N-methyl-1-phenylmethanamine
CID 105083589

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine?
The IUPAC name of [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine (CID 105294298) is [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine.
What is the SMILES notation for [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine?
The canonical SMILES for [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine is CC(C)CCC(NN)C1OCCc2ccccc21.
What is the InChIKey of [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine?
The InChIKey is CWKVHIIOUFTIMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(2)7-8-14(17-16)15-13-6-4-3-5-12(13)9-10-18-15/h3-6,11,14-15,17H,7-10,16H2,1-2H3.
What are the key properties of [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine?
[1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine has a molecular weight of 248.37 g/mol, XLogP of 2.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine is sourced from PubChem (CID 105294298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).