2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine

C11H16N2O — CID 114984667

IUPAC2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine
SMILESNNCCC1OCCc2ccccc21
InChIInChI=1S/C11H16N2O/c12-13-7-5-11-10-4-2-1-3-9(10)6-8-14-11/h1-4,11,13H,5-8,12H2
InChIKeySIVUOQHYVZTEKR-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.15
Rot. Bonds3

About 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine

2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine (PubChem CID 114984667) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine.

Molecular Properties

Compound Name2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine
PubChem CID114984667
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine
SMILESNNCCC1OCCc2ccccc21
InChIInChI=1S/C11H16N2O/c12-13-7-5-11-10-4-2-1-3-9(10)6-8-14-11/h1-4,11,13H,5-8,12H2
InChIKeySIVUOQHYVZTEKR-UHFFFAOYSA-N
XLogP1.15
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.15
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-(3,4-dihydro-1H-isochromen-1-yl)-N-methylethanamine
CID 14141276
1-(iodomethyl)-3,4-dihydro-1H-isochromene
CID 64788937
[(1R)-3,4-dihydro-1H-isochromen-1-yl]methanethiol
CID 129369937
3-(3,4-dihydro-1H-isochromen-1-yl)propanoic acid
CID 23288809
4-(3,4-dihydro-1H-isochromen-1-yl)-2-methyl-N-propylbutan-1-amine
CID 64664343
N,N-dibenzyl-2-[(1S)-3,4-dihydro-1H-isochromen-1-yl]ethanamine
CID 138551050
[1-(3,4-dihydro-1H-isochromen-1-yl)-3-methylpentan-2-yl]hydrazine
CID 114984660
N-tert-butyl-4-(3,4-dihydro-1H-isochromen-1-yl)-2-methylbutan-1-amine
CID 64665007
[1-cycloheptyl-2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]hydrazine
CID 114984729
1-(3,4-dihydro-1H-isochromen-1-yl)-2-methyl-3-(methylamino)propan-2-ol
CID 66040537
[2-(3,4-dihydro-1H-isochromen-1-yl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 114984506
[2-(3,4-dihydro-1H-isochromen-1-yl)-1-(4-iodophenyl)ethyl]hydrazine
CID 114985317

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine?
The IUPAC name of 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine (CID 114984667) is 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine.
What is the SMILES notation for 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine?
The canonical SMILES for 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine is NNCCC1OCCc2ccccc21.
What is the InChIKey of 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine?
The InChIKey is SIVUOQHYVZTEKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c12-13-7-5-11-10-4-2-1-3-9(10)6-8-14-11/h1-4,11,13H,5-8,12H2.
What are the key properties of 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine?
2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine has a molecular weight of 192.26 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydro-1H-isochromen-1-yl)ethylhydrazine is sourced from PubChem (CID 114984667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).