[2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine

C13H17ClN2O — CID 105209440

IUPAC[2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine
SMILESNNC(Cc1ccccc1Cl)C1=COCCC1
InChIInChI=1S/C13H17ClN2O/c14-12-6-2-1-4-10(12)8-13(16-15)11-5-3-7-17-9-11/h1-2,4,6,9,13,16H,3,5,7-8,15H2
InChIKeyPDMLABOAQRDMCS-UHFFFAOYSA-N
MW252.74 g/mol
LogP2.41
Rot. Bonds4

About [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine

[2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine (PubChem CID 105209440) has the molecular formula C13H17ClN2O and a molecular weight of 252.74 g/mol. Its IUPAC name is [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine
PubChem CID105209440
Molecular FormulaC13H17ClN2O
Molecular Weight252.74 g/mol
Exact Mass252.10
IUPAC Name[2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine
SMILESNNC(Cc1ccccc1Cl)C1=COCCC1
InChIInChI=1S/C13H17ClN2O/c14-12-6-2-1-4-10(12)8-13(16-15)11-5-3-7-17-9-11/h1-2,4,6,9,13,16H,3,5,7-8,15H2
InChIKeyPDMLABOAQRDMCS-UHFFFAOYSA-N
XLogP2.41
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.74
LogP ≤ 52.41
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-(2-chloro-4-fluorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine
CID 105216090
[(2-chlorophenyl)-(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 105210973
[1-(3,4-dihydro-2H-pyran-5-yl)-3-pyridin-2-ylpropyl]hydrazine
CID 105333191
[1-(3,4-dihydro-2H-pyran-5-yl)-2-methylsulfanylethyl]hydrazine
CID 105213767
[2-(2-bromophenyl)sulfanyl-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine
CID 105238050
[1-(3-bromo-5-chlorophenyl)-2-(2-chlorophenyl)ethyl]hydrazine
CID 114019513
[1-(3,4-dihydro-2H-pyran-5-yl)-4-methoxybutyl]hydrazine
CID 105224926
[1-(2-bromofuran-3-yl)-2-(2-chlorophenyl)ethyl]hydrazine
CID 106859708
[2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine
CID 105269073
2-(2-chlorophenyl)-1-(cyclopenten-1-yl)-N-ethylethanamine
CID 55034560
[2-(2-chlorophenyl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
CID 105209475
(2,3-dichlorophenyl)-(3,4-dihydro-2H-pyran-5-yl)methanamine
CID 105033531

Frequently Asked Questions

What is the IUPAC name of [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine (CID 105209440) is [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine is NNC(Cc1ccccc1Cl)C1=COCCC1.
What is the InChIKey of [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine?
The InChIKey is PDMLABOAQRDMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O/c14-12-6-2-1-4-10(12)8-13(16-15)11-5-3-7-17-9-11/h1-2,4,6,9,13,16H,3,5,7-8,15H2.
What are the key properties of [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine?
[2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine has a molecular weight of 252.74 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chlorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105209440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).