1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one

C15H23N3O — CID 117408491

IUPAC1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one
SMILESCC(C)N1CCN(c2ccccc2C(C)(C)N)C1=O
InChIInChI=1S/C15H23N3O/c1-11(2)17-9-10-18(14(17)19)13-8-6-5-7-12(13)15(3,4)16/h5-8,11H,9-10,16H2,1-4H3
InChIKeySEBUWLSOTKWEPH-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.53
Rot. Bonds3

About 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one

1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one (PubChem CID 117408491) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one
PubChem CID117408491
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one
SMILESCC(C)N1CCN(c2ccccc2C(C)(C)N)C1=O
InChIInChI=1S/C15H23N3O/c1-11(2)17-9-10-18(14(17)19)13-8-6-5-7-12(13)15(3,4)16/h5-8,11H,9-10,16H2,1-4H3
InChIKeySEBUWLSOTKWEPH-UHFFFAOYSA-N
XLogP2.53
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one?
The IUPAC name of 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one (CID 117408491) is 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one.
What is the SMILES notation for 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one?
The canonical SMILES for 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one is CC(C)N1CCN(c2ccccc2C(C)(C)N)C1=O.
What is the InChIKey of 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one?
The InChIKey is SEBUWLSOTKWEPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)17-9-10-18(14(17)19)13-8-6-5-7-12(13)15(3,4)16/h5-8,11H,9-10,16H2,1-4H3.
What are the key properties of 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one?
1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one has a molecular weight of 261.37 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-aminopropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one is sourced from PubChem (CID 117408491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).