4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide

C10H11F3N2O2 — CID 140553367

IUPAC4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide
SMILESCC(CC(F)(F)F)(Oc1ccccn1)C(N)=O
InChIInChI=1S/C10H11F3N2O2/c1-9(8(14)16,6-10(11,12)13)17-7-4-2-3-5-15-7/h2-5H,6H2,1H3,(H2,14,16)
InChIKeyFNLKRXONYRQLHK-UHFFFAOYSA-N
MW248.20 g/mol
LogP1.66
Rot. Bonds4

About 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide

4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide (PubChem CID 140553367) has the molecular formula C10H11F3N2O2 and a molecular weight of 248.20 g/mol. Its IUPAC name is 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide.

Molecular Properties

Compound Name4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide
PubChem CID140553367
Molecular FormulaC10H11F3N2O2
Molecular Weight248.20 g/mol
Exact Mass248.08
IUPAC Name4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide
SMILESCC(CC(F)(F)F)(Oc1ccccn1)C(N)=O
InChIInChI=1S/C10H11F3N2O2/c1-9(8(14)16,6-10(11,12)13)17-7-4-2-3-5-15-7/h2-5H,6H2,1H3,(H2,14,16)
InChIKeyFNLKRXONYRQLHK-UHFFFAOYSA-N
XLogP1.66
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.20
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-pyridin-2-yloxypropan-1-amine
CID 117051394
2-[bromo(difluoro)methoxy]pyridine
CID 66668027
2-pyridin-2-yloxypropane-2-thiol
CID 123837409
2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide
CID 3054960
3,3-dichloro-2-phenoxy-2-pyridin-2-yloxypropanamide
CID 70631337
4-(pyridin-2-yloxymethyl)benzoic acid
CID 21105508
(1-fluoro-1-pyridin-2-ylethyl) carbamate
CID 66697846
2-methyl-1-pyridin-2-yloxypropan-2-ol
CID 89434781
pyridin-2-yl ethaneperoxoate
CID 87694158
2-methyl-1-pyridin-2-yloxypropan-2-amine
CID 51684261
pyridin-2-amine;3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
CID 158875352
3-aminoprop-2-enyl 2-phenoxy-2-pyridin-2-yloxypropanoate
CID 70574581

Frequently Asked Questions

What is the IUPAC name of 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide?
The IUPAC name of 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide (CID 140553367) is 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide.
What is the SMILES notation for 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide?
The canonical SMILES for 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide is CC(CC(F)(F)F)(Oc1ccccn1)C(N)=O.
What is the InChIKey of 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide?
The InChIKey is FNLKRXONYRQLHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O2/c1-9(8(14)16,6-10(11,12)13)17-7-4-2-3-5-15-7/h2-5H,6H2,1H3,(H2,14,16).
What are the key properties of 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide?
4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide has a molecular weight of 248.20 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,4-trifluoro-2-methyl-2-pyridin-2-yloxybutanamide is sourced from PubChem (CID 140553367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).