[3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine

C12H13F3N2O — CID 105208035

IUPAC[3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine
SMILESNNC(C1=COCCC1)c1cc(F)c(F)c(F)c1
InChIInChI=1S/C12H13F3N2O/c13-9-4-8(5-10(14)11(9)15)12(17-16)7-2-1-3-18-6-7/h4-6,12,17H,1-3,16H2
InChIKeyFVYDWKNIUFJVEV-UHFFFAOYSA-N
MW258.24 g/mol
LogP2.30
Rot. Bonds3

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

[3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine (PubChem CID 105208035) has the molecular formula C12H13F3N2O and a molecular weight of 258.24 g/mol. Its IUPAC name is [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine
PubChem CID105208035
Molecular FormulaC12H13F3N2O
Molecular Weight258.24 g/mol
Exact Mass258.10
IUPAC Name[3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine
SMILESNNC(C1=COCCC1)c1cc(F)c(F)c(F)c1
InChIInChI=1S/C12H13F3N2O/c13-9-4-8(5-10(14)11(9)15)12(17-16)7-2-1-3-18-6-7/h4-6,12,17H,1-3,16H2
InChIKeyFVYDWKNIUFJVEV-UHFFFAOYSA-N
XLogP2.30
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.24
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3,4-dihydro-2H-pyran-5-yl-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 105333247
[(3-bromo-5-chlorophenyl)-(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 107948477
[3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine
CID 105333272
[(3-chloro-4-methylphenyl)-(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 105333182
1-(4-bromo-3-fluorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)-N-methylmethanamine
CID 105033121
[3,4-dihydro-2H-pyran-5-yl-(2-methylsulfanylphenyl)methyl]hydrazine
CID 105333174
1-(4-chloro-2,5-difluorophenyl)-1-(3,4-dihydro-2H-pyran-5-yl)-N-methylmethanamine
CID 105033221
[(2-chlorophenyl)-(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 105210973
[3,4-dihydro-2H-pyran-5-yl-(2,5-dimethylpyrazol-3-yl)methyl]hydrazine
CID 105333213
[3,4-dihydro-2H-pyran-5-yl-(4-methylthiophen-3-yl)methyl]hydrazine
CID 105251691
[3,4-dihydro-2H-pyran-5-yl-(6-methoxypyridazin-3-yl)methyl]hydrazine
CID 103375762
[(5-bromo-2-pyridinyl)-(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 105267637

Frequently Asked Questions

What is the IUPAC name of [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine?
The IUPAC name of [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine (CID 105208035) is [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine.
What is the SMILES notation for [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine?
The canonical SMILES for [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine is NNC(C1=COCCC1)c1cc(F)c(F)c(F)c1.
What is the InChIKey of [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine?
The InChIKey is FVYDWKNIUFJVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F3N2O/c13-9-4-8(5-10(14)11(9)15)12(17-16)7-2-1-3-18-6-7/h4-6,12,17H,1-3,16H2.
What are the key properties of [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine?
[3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine has a molecular weight of 258.24 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105208035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).