1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol

C11H15F3N4O — CID 144874670

IUPAC1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol
SMILESC=C1N(C)C(C)C(O)N1c1cc(C(F)(F)F)n(C)n1
InChIInChI=1S/C11H15F3N4O/c1-6-10(19)18(7(2)16(6)3)9-5-8(11(12,13)14)17(4)15-9/h5-6,10,19H,2H2,1,3-4H3
InChIKeyJWXVJUFAGRUBEY-UHFFFAOYSA-N
MW276.26 g/mol
LogP1.37
Rot. Bonds1

About 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol

1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol (PubChem CID 144874670) has the molecular formula C11H15F3N4O and a molecular weight of 276.26 g/mol. Its IUPAC name is 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol.

Molecular Properties

Compound Name1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol
PubChem CID144874670
Molecular FormulaC11H15F3N4O
Molecular Weight276.26 g/mol
Exact Mass276.12
IUPAC Name1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol
SMILESC=C1N(C)C(C)C(O)N1c1cc(C(F)(F)F)n(C)n1
InChIInChI=1S/C11H15F3N4O/c1-6-10(19)18(7(2)16(6)3)9-5-8(11(12,13)14)17(4)15-9/h5-6,10,19H,2H2,1,3-4H3
InChIKeyJWXVJUFAGRUBEY-UHFFFAOYSA-N
XLogP1.37
TPSA44.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.26
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol?
The IUPAC name of 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol (CID 144874670) is 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol.
What is the SMILES notation for 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol?
The canonical SMILES for 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol is C=C1N(C)C(C)C(O)N1c1cc(C(F)(F)F)n(C)n1.
What is the InChIKey of 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol?
The InChIKey is JWXVJUFAGRUBEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N4O/c1-6-10(19)18(7(2)16(6)3)9-5-8(11(12,13)14)17(4)15-9/h5-6,10,19H,2H2,1,3-4H3.
What are the key properties of 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol?
1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol has a molecular weight of 276.26 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-2-methylidene-3-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]imidazolidin-4-ol is sourced from PubChem (CID 144874670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).