1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one

C15H22ClN3O — CID 3038492

IUPAC1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one
SMILESCC(CN(C)C)N1C(=O)N(c2ccc(Cl)cc2)CC1C
InChIInChI=1S/C15H22ClN3O/c1-11(9-17(3)4)19-12(2)10-18(15(19)20)14-7-5-13(16)6-8-14/h5-8,11-12H,9-10H2,1-4H3
InChIKeyXLPGZYXBXMCYJJ-UHFFFAOYSA-N
MW295.81 g/mol
LogP2.92
Rot. Bonds4

About 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one

1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one (PubChem CID 3038492) has the molecular formula C15H22ClN3O and a molecular weight of 295.81 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one
PubChem CID3038492
Molecular FormulaC15H22ClN3O
Molecular Weight295.81 g/mol
Exact Mass295.15
IUPAC Name1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one
SMILESCC(CN(C)C)N1C(=O)N(c2ccc(Cl)cc2)CC1C
InChIInChI=1S/C15H22ClN3O/c1-11(9-17(3)4)19-12(2)10-18(15(19)20)14-7-5-13(16)6-8-14/h5-8,11-12H,9-10H2,1-4H3
InChIKeyXLPGZYXBXMCYJJ-UHFFFAOYSA-N
XLogP2.92
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one?
The IUPAC name of 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one (CID 3038492) is 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one.
What is the SMILES notation for 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one?
The canonical SMILES for 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one is CC(CN(C)C)N1C(=O)N(c2ccc(Cl)cc2)CC1C.
What is the InChIKey of 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one?
The InChIKey is XLPGZYXBXMCYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN3O/c1-11(9-17(3)4)19-12(2)10-18(15(19)20)14-7-5-13(16)6-8-14/h5-8,11-12H,9-10H2,1-4H3.
What are the key properties of 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one?
1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one has a molecular weight of 295.81 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-3-[1-(dimethylamino)propan-2-yl]-4-methylimidazolidin-2-one is sourced from PubChem (CID 3038492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).