3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one

C13H24N2O — CID 83257317

IUPAC3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
SMILESCC(C)CC1NCN(C(C)CC2CC2)C1=O
InChIInChI=1S/C13H24N2O/c1-9(2)6-12-13(16)15(8-14-12)10(3)7-11-4-5-11/h9-12,14H,4-8H2,1-3H3
InChIKeyHCISOVNBCQVQFT-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.98
Rot. Bonds5

About 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one

3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one (PubChem CID 83257317) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
PubChem CID83257317
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
SMILESCC(C)CC1NCN(C(C)CC2CC2)C1=O
InChIInChI=1S/C13H24N2O/c1-9(2)6-12-13(16)15(8-14-12)10(3)7-11-4-5-11/h9-12,14H,4-8H2,1-3H3
InChIKeyHCISOVNBCQVQFT-UHFFFAOYSA-N
XLogP1.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one (CID 83257317) is 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one is CC(C)CC1NCN(C(C)CC2CC2)C1=O.
What is the InChIKey of 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one?
The InChIKey is HCISOVNBCQVQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-9(2)6-12-13(16)15(8-14-12)10(3)7-11-4-5-11/h9-12,14H,4-8H2,1-3H3.
What are the key properties of 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one?
3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one has a molecular weight of 224.35 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83257317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).