1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine

C14H22N2O — CID 105293861

IUPAC1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine
SMILESCCCCC(NN)C1OCCc2ccccc21
InChIInChI=1S/C14H22N2O/c1-2-3-8-13(16-15)14-12-7-5-4-6-11(12)9-10-17-14/h4-7,13-14,16H,2-3,8-10,15H2,1H3
InChIKeyLINJVEHCZDIZHA-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.32
Rot. Bonds5

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

1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine (PubChem CID 105293861) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine.

Molecular Properties

Compound Name1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine
PubChem CID105293861
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine
SMILESCCCCC(NN)C1OCCc2ccccc21
InChIInChI=1S/C14H22N2O/c1-2-3-8-13(16-15)14-12-7-5-4-6-11(12)9-10-17-14/h4-7,13-14,16H,2-3,8-10,15H2,1H3
InChIKeyLINJVEHCZDIZHA-UHFFFAOYSA-N
XLogP2.32
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.32
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)-4-methylpentyl]hydrazine
CID 105294298
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)heptan-1-amine
CID 105125796
[1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine
CID 105284785
(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-(3,4-dihydro-1H-isochromen-1-yl)-N-ethylethanamine
CID 12536020
1-(3,4-dihydro-1H-isochromen-1-yl)-2-ethoxy-N-ethylethanamine
CID 105165027
1-(3,4-dihydro-1H-isochromen-1-yl)-N-ethylbut-3-yn-1-amine
CID 105077265
1-(3,4-dihydro-1H-isochromen-1-yl)-N,3-dimethylbut-3-en-1-amine
CID 105162904

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine?
The IUPAC name of 1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine (CID 105293861) is 1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine.
What is the SMILES notation for 1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine?
The canonical SMILES for 1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine is CCCCC(NN)C1OCCc2ccccc21.
What is the InChIKey of 1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine?
The InChIKey is LINJVEHCZDIZHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-2-3-8-13(16-15)14-12-7-5-4-6-11(12)9-10-17-14/h4-7,13-14,16H,2-3,8-10,15H2,1H3.
What are the key properties of 1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine?
1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine has a molecular weight of 234.34 g/mol, XLogP of 2.32, 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)pentylhydrazine is sourced from PubChem (CID 105293861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).