4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one

C13H26N2O — CID 167554193

IUPAC4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one
SMILESCC(C)N1C(=O)N(C(C)C)C(C)(C)C1(C)C
InChIInChI=1S/C13H26N2O/c1-9(2)14-11(16)15(10(3)4)13(7,8)12(14,5)6/h9-10H,1-8H3
InChIKeyCUHOYQATZACXRK-UHFFFAOYSA-N
MW226.36 g/mol
LogP3.10
Rot. Bonds2

About 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one

4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one (PubChem CID 167554193) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one.

Molecular Properties

Compound Name4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one
PubChem CID167554193
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one
SMILESCC(C)N1C(=O)N(C(C)C)C(C)(C)C1(C)C
InChIInChI=1S/C13H26N2O/c1-9(2)14-11(16)15(10(3)4)13(7,8)12(14,5)6/h9-10H,1-8H3
InChIKeyCUHOYQATZACXRK-UHFFFAOYSA-N
XLogP3.10
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4,4-dimethyl-1-propan-2-ylazetidin-2-one
CID 15269781
3,6,6-trimethyl-1-propan-2-ylpiperazine-2,5-dione
CID 64874694
4-imino-5,5-dimethyl-1-propan-2-ylimidazolidin-2-one
CID 138390712
4-amino-5-methyl-5-(2-methylpropyl)-1-propan-2-ylimidazol-2-one
CID 79967769
4-amino-5-butan-2-yl-5-methyl-1-propan-2-ylimidazol-2-one
CID 79967581
3,5,5-trimethyl-1-propan-2-yl-2-propan-2-ylideneimidazolidin-4-one
CID 59344702
1,3-di(propan-2-yl)-1,3-diazinan-2-one;ethane
CID 157428700
3,3-diethyl-6,6-dimethyl-1-propan-2-ylpiperazine-2,5-dione
CID 64886554
methyl 2-[3-(1,2-dimethoxy-2-oxoethyl)-4,4,5,5,6,6-hexamethyl-2-oxo-1,3-diazinan-1-yl]-2-methoxyacetate
CID 59871972
4-propan-2-yl-1-oxa-4-azaspiro[4.5]deca-6,9-diene-3,8-dione
CID 14475486
6-cyclopropyl-3-ethyl-6-methyl-1-propan-2-ylpiperazine-2,5-dione
CID 64900730
5-propan-2-yl-2,5,7-triazaspiro[3.4]octan-6-one
CID 105434190

Frequently Asked Questions

What is the IUPAC name of 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one?
The IUPAC name of 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one (CID 167554193) is 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one.
What is the SMILES notation for 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one?
The canonical SMILES for 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one is CC(C)N1C(=O)N(C(C)C)C(C)(C)C1(C)C.
What is the InChIKey of 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one?
The InChIKey is CUHOYQATZACXRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-9(2)14-11(16)15(10(3)4)13(7,8)12(14,5)6/h9-10H,1-8H3.
What are the key properties of 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one?
4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one has a molecular weight of 226.36 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,5,5-tetramethyl-1,3-di(propan-2-yl)imidazolidin-2-one is sourced from PubChem (CID 167554193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).