1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one

C10H18N2O2 — CID 116982982

IUPAC1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one
SMILESCN1CC(C2CCOCC2)N(C)C1=O
InChIInChI=1S/C10H18N2O2/c1-11-7-9(12(2)10(11)13)8-3-5-14-6-4-8/h8-9H,3-7H2,1-2H3
InChIKeySAQSHDSZUQGXEK-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.78
Rot. Bonds1

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

1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one (PubChem CID 116982982) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one
PubChem CID116982982
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one
SMILESCN1CC(C2CCOCC2)N(C)C1=O
InChIInChI=1S/C10H18N2O2/c1-11-7-9(12(2)10(11)13)8-3-5-14-6-4-8/h8-9H,3-7H2,1-2H3
InChIKeySAQSHDSZUQGXEK-UHFFFAOYSA-N
XLogP0.78
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-amino-2-methylpropyl)-3-methyl-4-(oxan-4-yl)imidazolidin-2-one
CID 116981420
3-methyl-1-[3-(methylamino)propyl]-4-(oxan-4-yl)imidazolidin-2-one
CID 116981500
methyl 2-[3-methyl-4-(oxan-4-yl)-2-oxoimidazolidin-1-yl]acetate
CID 116982587
1-methyl-2-(oxan-4-yl)pyrrolidine
CID 76626708
4-cyclobutyl-3-methyl-1-(morpholin-3-ylmethyl)imidazolidin-2-one
CID 116982801
4-cyclopentyl-3-methyl-1-(morpholin-3-ylmethyl)imidazolidin-2-one
CID 116982800
(3R)-1-methyl-3-(oxan-4-yl)piperazine-2,5-dione
CID 129499724
3-methyl-4-(1-methylpiperidin-4-yl)-2-oxoimidazolidine-1-carbonitrile
CID 116982424
2-(4-cyclobutyl-3-methyl-2-oxoimidazolidin-1-yl)-2-methylpropanoic acid
CID 116982096
3-methyl-4-(1-methylpiperidin-4-yl)-1-(2-sulfanylethyl)imidazolidin-2-one
CID 116982267
4-ethyl-1,3-dimethylimidazolidin-2-one
CID 18386713
4-cyclobutyl-3-methyl-1-[4-(methylamino)cyclohexyl]imidazolidin-2-one
CID 116981933

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one?
The IUPAC name of 1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one (CID 116982982) is 1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one.
What is the SMILES notation for 1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one?
The canonical SMILES for 1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one is CN1CC(C2CCOCC2)N(C)C1=O.
What is the InChIKey of 1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one?
The InChIKey is SAQSHDSZUQGXEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-11-7-9(12(2)10(11)13)8-3-5-14-6-4-8/h8-9H,3-7H2,1-2H3.
What are the key properties of 1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one?
1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one has a molecular weight of 198.27 g/mol, XLogP of 0.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-(oxan-4-yl)imidazolidin-2-one is sourced from PubChem (CID 116982982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).