ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol

C14H20F3N3O — CID 144833520

IUPACethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol
SMILESC=C1N(C)CC(O)N1c1cc(C(F)(F)F)c(C)cn1.CC
InChIInChI=1S/C12H14F3N3O.C2H6/c1-7-5-16-10(4-9(7)12(13,14)15)18-8(2)17(3)6-11(18)19;1-2/h4-5,11,19H,2,6H2,1,3H3;1-2H3
InChIKeyFGUWBEKKSSDJGP-UHFFFAOYSA-N
MW303.33 g/mol
LogP2.98
Rot. Bonds1

About ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol

ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol (PubChem CID 144833520) has the molecular formula C14H20F3N3O and a molecular weight of 303.33 g/mol. Its IUPAC name is ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol.

Molecular Properties

Compound Nameethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol
PubChem CID144833520
Molecular FormulaC14H20F3N3O
Molecular Weight303.33 g/mol
Exact Mass303.16
IUPAC Nameethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol
SMILESC=C1N(C)CC(O)N1c1cc(C(F)(F)F)c(C)cn1.CC
InChIInChI=1S/C12H14F3N3O.C2H6/c1-7-5-16-10(4-9(7)12(13,14)15)18-8(2)17(3)6-11(18)19;1-2/h4-5,11,19H,2,6H2,1,3H3;1-2H3
InChIKeyFGUWBEKKSSDJGP-UHFFFAOYSA-N
XLogP2.98
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol?
The IUPAC name of ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol (CID 144833520) is ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol.
What is the SMILES notation for ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol?
The canonical SMILES for ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol is C=C1N(C)CC(O)N1c1cc(C(F)(F)F)c(C)cn1.CC.
What is the InChIKey of ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol?
The InChIKey is FGUWBEKKSSDJGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F3N3O.C2H6/c1-7-5-16-10(4-9(7)12(13,14)15)18-8(2)17(3)6-11(18)19;1-2/h4-5,11,19H,2,6H2,1,3H3;1-2H3.
What are the key properties of ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol?
ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol has a molecular weight of 303.33 g/mol, XLogP of 2.98, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-2-methylidene-3-[5-methyl-4-(trifluoromethyl)-2-pyridinyl]imidazolidin-4-ol is sourced from PubChem (CID 144833520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).