[1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine

C14H19F3N2O — CID 102759720

IUPAC[1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine
SMILESCc1cc(C(F)(F)F)ccc1C(CC1CCOC1)NN
InChIInChI=1S/C14H19F3N2O/c1-9-6-11(14(15,16)17)2-3-12(9)13(19-18)7-10-4-5-20-8-10/h2-3,6,10,13,19H,4-5,7-8,18H2,1H3
InChIKeyGMHQVUUVQXHAAZ-UHFFFAOYSA-N
MW288.31 g/mol
LogP2.94
Rot. Bonds4

About [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine

[1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine (PubChem CID 102759720) has the molecular formula C14H19F3N2O and a molecular weight of 288.31 g/mol. Its IUPAC name is [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine
PubChem CID102759720
Molecular FormulaC14H19F3N2O
Molecular Weight288.31 g/mol
Exact Mass288.14
IUPAC Name[1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine
SMILESCc1cc(C(F)(F)F)ccc1C(CC1CCOC1)NN
InChIInChI=1S/C14H19F3N2O/c1-9-6-11(14(15,16)17)2-3-12(9)13(19-18)7-10-4-5-20-8-10/h2-3,6,10,13,19H,4-5,7-8,18H2,1H3
InChIKeyGMHQVUUVQXHAAZ-UHFFFAOYSA-N
XLogP2.94
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 52.94
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-fluoro-4-methylphenyl)-2-(oxolan-3-yl)ethyl]hydrazine
CID 107130877
N-methyl-2-(oxolan-3-yl)-1-[3-(trifluoromethyl)phenyl]ethanamine
CID 103986937
2-cyclopentyl-N-ethyl-1-[2-methyl-4-(trifluoromethyl)phenyl]ethanamine
CID 102758480
3-cyclopentyl-N-methyl-1-[2-methyl-4-(trifluoromethyl)phenyl]propan-1-amine
CID 102757776
N-methyl-1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(thian-4-yl)ethanamine
CID 102757909
N-methyl-2-(oxolan-3-yl)-1-(2,4,5-trimethylphenyl)ethanamine
CID 113362151
N-[2-(oxolan-3-yl)-1-[3-(trifluoromethyl)phenyl]ethyl]propan-1-amine
CID 103987462
[1-[2-methyl-4-(trifluoromethyl)phenyl]-2-phenylethyl]hydrazine
CID 102759408
[1-[2-bromo-5-(trifluoromethyl)phenyl]-2-cyclobutylethyl]hydrazine
CID 105310132
[2-(oxan-4-yl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethyl]hydrazine
CID 105298819
N-[[2-methyl-4-(trifluoromethyl)phenyl]-(oxolan-3-yl)methyl]propan-1-amine
CID 102754281
[1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine
CID 105266240

Frequently Asked Questions

What is the IUPAC name of [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine?
The IUPAC name of [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine (CID 102759720) is [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine is Cc1cc(C(F)(F)F)ccc1C(CC1CCOC1)NN.
What is the InChIKey of [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine?
The InChIKey is GMHQVUUVQXHAAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O/c1-9-6-11(14(15,16)17)2-3-12(9)13(19-18)7-10-4-5-20-8-10/h2-3,6,10,13,19H,4-5,7-8,18H2,1H3.
What are the key properties of [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine?
[1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine has a molecular weight of 288.31 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-methyl-4-(trifluoromethyl)phenyl]-2-(oxolan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 102759720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).