3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one

C16H25N3O — CID 83249374

IUPAC3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one
SMILESCCN(CC)CC(C)N1CNC(c2ccccc2)C1=O
InChIInChI=1S/C16H25N3O/c1-4-18(5-2)11-13(3)19-12-17-15(16(19)20)14-9-7-6-8-10-14/h6-10,13,15,17H,4-5,11-12H2,1-3H3
InChIKeyFXRWLTPABWVDAN-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.85
Rot. Bonds6

About 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one

3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one (PubChem CID 83249374) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one.

Molecular Properties

Compound Name3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one
PubChem CID83249374
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one
SMILESCCN(CC)CC(C)N1CNC(c2ccccc2)C1=O
InChIInChI=1S/C16H25N3O/c1-4-18(5-2)11-13(3)19-12-17-15(16(19)20)14-9-7-6-8-10-14/h6-10,13,15,17H,4-5,11-12H2,1-3H3
InChIKeyFXRWLTPABWVDAN-UHFFFAOYSA-N
XLogP1.85
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one?
The IUPAC name of 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one (CID 83249374) is 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one.
What is the SMILES notation for 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one?
The canonical SMILES for 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one is CCN(CC)CC(C)N1CNC(c2ccccc2)C1=O.
What is the InChIKey of 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one?
The InChIKey is FXRWLTPABWVDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-4-18(5-2)11-13(3)19-12-17-15(16(19)20)14-9-7-6-8-10-14/h6-10,13,15,17H,4-5,11-12H2,1-3H3.
What are the key properties of 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one?
3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one has a molecular weight of 275.40 g/mol, XLogP of 1.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(diethylamino)propan-2-yl]-5-phenylimidazolidin-4-one is sourced from PubChem (CID 83249374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).