ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide

C12H17F3N2O2 — CID 143180631

IUPACethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide
SMILESCC.CC(C)(Oc1ccc(C(F)(F)F)cn1)C(N)=O
InChIInChI=1S/C10H11F3N2O2.C2H6/c1-9(2,8(14)16)17-7-4-3-6(5-15-7)10(11,12)13;1-2/h3-5H,1-2H3,(H2,14,16);1-2H3
InChIKeyWNZPCVPOOAUGGW-UHFFFAOYSA-N
MW278.27 g/mol
LogP2.77
Rot. Bonds3

About ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide

ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide (PubChem CID 143180631) has the molecular formula C12H17F3N2O2 and a molecular weight of 278.27 g/mol. Its IUPAC name is ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide.

Molecular Properties

Compound Nameethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide
PubChem CID143180631
Molecular FormulaC12H17F3N2O2
Molecular Weight278.27 g/mol
Exact Mass278.12
IUPAC Nameethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide
SMILESCC.CC(C)(Oc1ccc(C(F)(F)F)cn1)C(N)=O
InChIInChI=1S/C10H11F3N2O2.C2H6/c1-9(2,8(14)16)17-7-4-3-6(5-15-7)10(11,12)13;1-2/h3-5H,1-2H3,(H2,14,16);1-2H3
InChIKeyWNZPCVPOOAUGGW-UHFFFAOYSA-N
XLogP2.77
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.27
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-[4-(trifluoromethyl)phenoxy]propanamide
CID 162567943
N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide
CID 164531892
[5-(trifluoromethyl)-2-pyridinyl] 2-hydroxyacetate
CID 86171784
2-methylsulfanyloxy-5-(trifluoromethyl)pyridine
CID 129204089
4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]benzoic acid
CID 3730311
(2R)-1-[[5-(trifluoromethyl)-2-pyridinyl]oxy]butan-2-amine
CID 97179058
2-(2-methylpentoxy)-5-(trifluoromethyl)pyridine
CID 162563286
butyl 2-methyl-2-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]hexanoate
CID 139807732
ethane;methyl 5-(trifluoromethyl)pyridine-2-carboxylate;2-[5-(trifluoromethyl)-2-pyridinyl]propan-2-ol
CID 163274429
3-[(3S)-1-(4-chlorophenyl)-3-[[2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanoyl]amino]butan-2-yl]benzamide
CID 163924092
3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propan-1-amine
CID 22175085
2-(2-methoxyphenoxy)-5-(trifluoromethyl)pyridine
CID 70516115

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide?
The IUPAC name of ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide (CID 143180631) is ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide.
What is the SMILES notation for ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide?
The canonical SMILES for ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide is CC.CC(C)(Oc1ccc(C(F)(F)F)cn1)C(N)=O.
What is the InChIKey of ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide?
The InChIKey is WNZPCVPOOAUGGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O2.C2H6/c1-9(2,8(14)16)17-7-4-3-6(5-15-7)10(11,12)13;1-2/h3-5H,1-2H3,(H2,14,16);1-2H3.
What are the key properties of ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide?
ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide has a molecular weight of 278.27 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide is sourced from PubChem (CID 143180631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).