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

C9H18N2O — CID 22024133

IUPAC1,3-di(propan-2-yl)imidazolidin-2-one
SMILESCC(C)N1CCN(C(C)C)C1=O
InChIInChI=1S/C9H18N2O/c1-7(2)10-5-6-11(8(3)4)9(10)12/h7-8H,5-6H2,1-4H3
InChIKeyAZLXQBNSOMJQEJ-UHFFFAOYSA-N
MW170.26 g/mol
LogP1.54
Rot. Bonds2

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

1,3-di(propan-2-yl)imidazolidin-2-one (PubChem CID 22024133) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 1,3-di(propan-2-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1,3-di(propan-2-yl)imidazolidin-2-one
PubChem CID22024133
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name1,3-di(propan-2-yl)imidazolidin-2-one
SMILESCC(C)N1CCN(C(C)C)C1=O
InChIInChI=1S/C9H18N2O/c1-7(2)10-5-6-11(8(3)4)9(10)12/h7-8H,5-6H2,1-4H3
InChIKeyAZLXQBNSOMJQEJ-UHFFFAOYSA-N
XLogP1.54
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,3-di(propan-2-yl)imidazolidin-2-one?
The IUPAC name of 1,3-di(propan-2-yl)imidazolidin-2-one (CID 22024133) is 1,3-di(propan-2-yl)imidazolidin-2-one.
What is the SMILES notation for 1,3-di(propan-2-yl)imidazolidin-2-one?
The canonical SMILES for 1,3-di(propan-2-yl)imidazolidin-2-one is CC(C)N1CCN(C(C)C)C1=O.
What is the InChIKey of 1,3-di(propan-2-yl)imidazolidin-2-one?
The InChIKey is AZLXQBNSOMJQEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(2)10-5-6-11(8(3)4)9(10)12/h7-8H,5-6H2,1-4H3.
What are the key properties of 1,3-di(propan-2-yl)imidazolidin-2-one?
1,3-di(propan-2-yl)imidazolidin-2-one has a molecular weight of 170.26 g/mol, XLogP of 1.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-di(propan-2-yl)imidazolidin-2-one is sourced from PubChem (CID 22024133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).