1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one

C10H16N4O — CID 58523787

IUPAC1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one
SMILESCC(C)(C)n1ccc(N2CCNC2=O)n1
InChIInChI=1S/C10H16N4O/c1-10(2,3)14-6-4-8(12-14)13-7-5-11-9(13)15/h4,6H,5,7H2,1-3H3,(H,11,15)
InChIKeyHURBAKUENAVSBN-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.17
Rot. Bonds1

About 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one

1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one (PubChem CID 58523787) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one
PubChem CID58523787
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one
SMILESCC(C)(C)n1ccc(N2CCNC2=O)n1
InChIInChI=1S/C10H16N4O/c1-10(2,3)14-6-4-8(12-14)13-7-5-11-9(13)15/h4,6H,5,7H2,1-3H3,(H,11,15)
InChIKeyHURBAKUENAVSBN-UHFFFAOYSA-N
XLogP1.17
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one?
The IUPAC name of 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one (CID 58523787) is 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one.
What is the SMILES notation for 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one?
The canonical SMILES for 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one is CC(C)(C)n1ccc(N2CCNC2=O)n1.
What is the InChIKey of 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one?
The InChIKey is HURBAKUENAVSBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-10(2,3)14-6-4-8(12-14)13-7-5-11-9(13)15/h4,6H,5,7H2,1-3H3,(H,11,15).
What are the key properties of 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one?
1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one has a molecular weight of 208.26 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-tert-butylpyrazol-3-yl)imidazolidin-2-one is sourced from PubChem (CID 58523787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).