6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine

C12H17F3N4O — CID 102720530

IUPAC6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
SMILESCN(CC1CCCO1)c1cc(C(F)(F)F)cc(NN)n1
InChIInChI=1S/C12H17F3N4O/c1-19(7-9-3-2-4-20-9)11-6-8(12(13,14)15)5-10(17-11)18-16/h5-6,9H,2-4,7,16H2,1H3,(H,17,18)
InChIKeyLZJCYHYAIGYIBO-UHFFFAOYSA-N
MW290.29 g/mol
LogP2.00
Rot. Bonds4

About 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine

6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102720530) has the molecular formula C12H17F3N4O and a molecular weight of 290.29 g/mol. Its IUPAC name is 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102720530
Molecular FormulaC12H17F3N4O
Molecular Weight290.29 g/mol
Exact Mass290.14
IUPAC Name6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
SMILESCN(CC1CCCO1)c1cc(C(F)(F)F)cc(NN)n1
InChIInChI=1S/C12H17F3N4O/c1-19(7-9-3-2-4-20-9)11-6-8(12(13,14)15)5-10(17-11)18-16/h5-6,9H,2-4,7,16H2,1H3,(H,17,18)
InChIKeyLZJCYHYAIGYIBO-UHFFFAOYSA-N
XLogP2.00
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

6-(2-Methylmorpholin-4-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 102717189
(Z)-1-[2-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]hydrazinyl]-2-nitro-N-(oxolan-2-ylmethyl)ethenamine
CID 142086893
6-[(2R)-2-methylmorpholin-4-yl]-4-(trifluoromethyl)pyridin-2-amine
CID 150302870
[6-(4,4-Difluoropiperidin-1-yl)-4-methyl-2-pyridinyl]hydrazine
CID 169266240
6-Morpholin-4-yl-4-(trifluoromethyl)-2-pyridylhydrazine
CID 60138061
N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
CID 66329642
3-(aminomethyl)-N-methyl-N-(oxolan-2-ylmethyl)-6-(trifluoromethyl)pyridin-2-amine
CID 79869664
3-(aminomethyl)-N-ethyl-N-(oxolan-2-ylmethyl)-6-(trifluoromethyl)pyridin-2-amine
CID 79873577
2-[Methyl(oxolan-2-ylmethyl)amino]-6-(trifluoromethyl)pyridine-3-carboximidamide
CID 79874807
6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine
CID 80909686
6-chloro-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715464
6-chloro-N-ethyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715598

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine (CID 102720530) is 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine is CN(CC1CCCO1)c1cc(C(F)(F)F)cc(NN)n1.
What is the InChIKey of 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is LZJCYHYAIGYIBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17F3N4O/c1-19(7-9-3-2-4-20-9)11-6-8(12(13,14)15)5-10(17-11)18-16/h5-6,9H,2-4,7,16H2,1H3,(H,17,18).
What are the key properties of 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine?
6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 290.29 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-methyl-N-(oxolan-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102720530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).