[(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine

C16H16Cl2N2O — CID 105233991

IUPAC[(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine
SMILESNNC(c1cc(Cl)ccc1Cl)C1COc2ccccc2C1
InChIInChI=1S/C16H16Cl2N2O/c17-12-5-6-14(18)13(8-12)16(20-19)11-7-10-3-1-2-4-15(10)21-9-11/h1-6,8,11,16,20H,7,9,19H2
InChIKeyINCIUXKOCUIDLM-UHFFFAOYSA-N
MW323.22 g/mol
LogP3.75
Rot. Bonds3

About [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine

[(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine (PubChem CID 105233991) has the molecular formula C16H16Cl2N2O and a molecular weight of 323.22 g/mol. Its IUPAC name is [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine
PubChem CID105233991
Molecular FormulaC16H16Cl2N2O
Molecular Weight323.22 g/mol
Exact Mass322.06
IUPAC Name[(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine
SMILESNNC(c1cc(Cl)ccc1Cl)C1COc2ccccc2C1
InChIInChI=1S/C16H16Cl2N2O/c17-12-5-6-14(18)13(8-12)16(20-19)11-7-10-3-1-2-4-15(10)21-9-11/h1-6,8,11,16,20H,7,9,19H2
InChIKeyINCIUXKOCUIDLM-UHFFFAOYSA-N
XLogP3.75
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.22
LogP ≤ 53.75
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

[(2,6-difluorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine
CID 105233931
[(3,5-difluorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine
CID 105234024
[(2-chlorophenyl)-(2,3-dihydro-1H-inden-2-yl)methyl]hydrazine
CID 105234082
[3,4-dihydro-2H-chromen-3-yl(thiophen-3-yl)methyl]hydrazine
CID 105233912
[3,4-dihydro-2H-chromen-3-yl(thiophen-2-yl)methyl]hydrazine
CID 105233943
(3-chlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methanamine
CID 65411666
[(2,5-dichlorophenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine
CID 105232515
[3,4-dihydro-2H-chromen-3-yl-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105233997
[3,4-dihydro-2H-chromen-3-yl(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 105233911
1-(3,4-dihydro-2H-chromen-3-yl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 65411667
(3-chloro-2,4-difluorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methanamine
CID 166045392
[cyclohexyl(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine
CID 105233964

Frequently Asked Questions

What is the IUPAC name of [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine?
The IUPAC name of [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine (CID 105233991) is [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine.
What is the SMILES notation for [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine?
The canonical SMILES for [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine is NNC(c1cc(Cl)ccc1Cl)C1COc2ccccc2C1.
What is the InChIKey of [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine?
The InChIKey is INCIUXKOCUIDLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O/c17-12-5-6-14(18)13(8-12)16(20-19)11-7-10-3-1-2-4-15(10)21-9-11/h1-6,8,11,16,20H,7,9,19H2.
What are the key properties of [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine?
[(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine has a molecular weight of 323.22 g/mol, XLogP of 3.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dichlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methyl]hydrazine is sourced from PubChem (CID 105233991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).