1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one

C8H12N4O — CID 102807965

IUPAC1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one
SMILESCc1nn(C)cc1N1CCNC1=O
InChIInChI=1S/C8H12N4O/c1-6-7(5-11(2)10-6)12-4-3-9-8(12)13/h5H,3-4H2,1-2H3,(H,9,13)
InChIKeyNJQPIPNWINBJBO-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.26
Rot. Bonds1

About 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one

1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one (PubChem CID 102807965) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one
PubChem CID102807965
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one
SMILESCc1nn(C)cc1N1CCNC1=O
InChIInChI=1S/C8H12N4O/c1-6-7(5-11(2)10-6)12-4-3-9-8(12)13/h5H,3-4H2,1-2H3,(H,9,13)
InChIKeyNJQPIPNWINBJBO-UHFFFAOYSA-N
XLogP0.26
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1,3-dimethylpyrazol-4-yl)-3-methylpiperazine-2,5-dione
CID 102807608
1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine
CID 174436389
1-[2-[(1,3-dimethylpyrazol-4-yl)methylamino]ethyl]imidazolidin-2-one
CID 112669012
1-(1,3-dimethylpyrazol-4-yl)-3-ethylpiperazine
CID 102807589
1-(4-methoxy-2-methylphenyl)imidazolidin-2-one
CID 115370632
1-(2-methylsulfanylphenyl)imidazolidin-2-one
CID 107647362
1-(2-methyl-4-pyridinyl)imidazolidin-2-one
CID 170628851
1-(4-methyl-2-pyridinyl)imidazolidin-2-one
CID 122219864
1-(1,3-dimethylpyrazol-4-yl)-3,6-dimethylpiperazine-2,5-dione
CID 102807643
1-(5-chloro-2-fluorophenyl)imidazolidin-2-one
CID 115370461
1-(2-methyl-4-nitrophenyl)imidazolidin-2-one
CID 115370555
5-amino-2-(1,3-dimethylpyrazol-4-yl)isoindole-1,3-dione
CID 102805951

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one?
The IUPAC name of 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one (CID 102807965) is 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one.
What is the SMILES notation for 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one?
The canonical SMILES for 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one is Cc1nn(C)cc1N1CCNC1=O.
What is the InChIKey of 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one?
The InChIKey is NJQPIPNWINBJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c1-6-7(5-11(2)10-6)12-4-3-9-8(12)13/h5H,3-4H2,1-2H3,(H,9,13).
What are the key properties of 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one?
1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one has a molecular weight of 180.21 g/mol, XLogP of 0.26, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethylpyrazol-4-yl)imidazolidin-2-one is sourced from PubChem (CID 102807965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).