1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one

C9H13N3O2 — CID 70555356

IUPAC1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one
SMILESCc1noc(N2CCN(C)C2=O)c1C
InChIInChI=1S/C9H13N3O2/c1-6-7(2)10-14-8(6)12-5-4-11(3)9(12)13/h4-5H2,1-3H3
InChIKeyGKTRDAZFDPXCMF-UHFFFAOYSA-N
MW195.22 g/mol
LogP1.16
Rot. Bonds1

About 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one

1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one (PubChem CID 70555356) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one
PubChem CID70555356
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one
SMILESCc1noc(N2CCN(C)C2=O)c1C
InChIInChI=1S/C9H13N3O2/c1-6-7(2)10-14-8(6)12-5-4-11(3)9(12)13/h4-5H2,1-3H3
InChIKeyGKTRDAZFDPXCMF-UHFFFAOYSA-N
XLogP1.16
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-3-propan-2-ylimidazolidine-2,4,5-trione
CID 32117010
2-[(4S)-1,3-dimethyl-2,5-dioxoimidazolidin-4-yl]-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide
CID 164640339
N,N,3,4-tetramethyl-1,2-oxazol-5-amine
CID 332040
1-(3-Methylisoxazol-5-yl)imidazolidin-2-one
CID 10975858
2-(diethylamino)-N-(3,4-dimethyl-1,2-oxazol-5-yl)acetamide
CID 56636
1-(3,4-Dimethyl-1,2-oxazol-5-yl)-3-(2,2,2-trifluoroethyl)urea
CID 116656456
N-(3,4-Dimethyl-1,2-oxazol-5-yl)urea
CID 57357233
N-(3,4-dimethyl-1,2-oxazol-5-yl)piperazine-1-carboxamide
CID 68778029
4-[(3,4-Dimethyl-1,2-oxazol-5-yl)carbamoyl]piperazine-1-carboxylic acid
CID 68780628
3-(3,4-dimethyl-1,2-oxazol-5-yl)-4-methyl-1H-imidazol-2-one
CID 70554758
5-(5-Hydroxy-5-methyl-2-oxoimidazolidin-1-yl)-3-methyl-1,2-oxazole-4-carbonitrile
CID 70554825
5-[5-(Hydroxymethyl)-2-oxoimidazolidin-1-yl]-3-methyl-1,2-oxazole-4-carbonitrile
CID 70554827

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one?
The IUPAC name of 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one (CID 70555356) is 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one.
What is the SMILES notation for 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one?
The canonical SMILES for 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one is Cc1noc(N2CCN(C)C2=O)c1C.
What is the InChIKey of 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one?
The InChIKey is GKTRDAZFDPXCMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-6-7(2)10-14-8(6)12-5-4-11(3)9(12)13/h4-5H2,1-3H3.
What are the key properties of 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one?
1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one has a molecular weight of 195.22 g/mol, XLogP of 1.16, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethyl-1,2-oxazol-5-yl)-3-methylimidazolidin-2-one is sourced from PubChem (CID 70555356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).