1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one

C11H15N3O3 — CID 3841621

IUPAC1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one
SMILESCc1cc(C)nc(N2C(=O)N(C)C(O)C2O)c1
InChIInChI=1S/C11H15N3O3/c1-6-4-7(2)12-8(5-6)14-10(16)9(15)13(3)11(14)17/h4-5,9-10,15-16H,1-3H3
InChIKeyVVYTYTFKXBBMKA-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.21
Rot. Bonds1

About 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one

1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one (PubChem CID 3841621) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one
PubChem CID3841621
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one
SMILESCc1cc(C)nc(N2C(=O)N(C)C(O)C2O)c1
InChIInChI=1S/C11H15N3O3/c1-6-4-7(2)12-8(5-6)14-10(16)9(15)13(3)11(14)17/h4-5,9-10,15-16H,1-3H3
InChIKeyVVYTYTFKXBBMKA-UHFFFAOYSA-N
XLogP0.21
TPSA76.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one?
The IUPAC name of 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one (CID 3841621) is 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one.
What is the SMILES notation for 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one?
The canonical SMILES for 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one is Cc1cc(C)nc(N2C(=O)N(C)C(O)C2O)c1.
What is the InChIKey of 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one?
The InChIKey is VVYTYTFKXBBMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-6-4-7(2)12-8(5-6)14-10(16)9(15)13(3)11(14)17/h4-5,9-10,15-16H,1-3H3.
What are the key properties of 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one?
1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one has a molecular weight of 237.26 g/mol, XLogP of 0.21, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethyl-2-pyridinyl)-4,5-dihydroxy-3-methylimidazolidin-2-one is sourced from PubChem (CID 3841621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).