1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one

C15H20ClN3O — CID 46881463

IUPAC1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one
SMILESO=C1N(CC2CCCCN2)CCN1c1cccc(Cl)c1
InChIInChI=1S/C15H20ClN3O/c16-12-4-3-6-14(10-12)19-9-8-18(15(19)20)11-13-5-1-2-7-17-13/h3-4,6,10,13,17H,1-2,5,7-9,11H2
InChIKeyHVSRNYNPOUFDNJ-UHFFFAOYSA-N
MW293.80 g/mol
LogP2.72
Rot. Bonds3

About 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one

1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one (PubChem CID 46881463) has the molecular formula C15H20ClN3O and a molecular weight of 293.80 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one
PubChem CID46881463
Molecular FormulaC15H20ClN3O
Molecular Weight293.80 g/mol
Exact Mass293.13
IUPAC Name1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one
SMILESO=C1N(CC2CCCCN2)CCN1c1cccc(Cl)c1
InChIInChI=1S/C15H20ClN3O/c16-12-4-3-6-14(10-12)19-9-8-18(15(19)20)11-13-5-1-2-7-17-13/h3-4,6,10,13,17H,1-2,5,7-9,11H2
InChIKeyHVSRNYNPOUFDNJ-UHFFFAOYSA-N
XLogP2.72
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one?
The IUPAC name of 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one (CID 46881463) is 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one.
What is the SMILES notation for 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one?
The canonical SMILES for 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one is O=C1N(CC2CCCCN2)CCN1c1cccc(Cl)c1.
What is the InChIKey of 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one?
The InChIKey is HVSRNYNPOUFDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O/c16-12-4-3-6-14(10-12)19-9-8-18(15(19)20)11-13-5-1-2-7-17-13/h3-4,6,10,13,17H,1-2,5,7-9,11H2.
What are the key properties of 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one?
1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one has a molecular weight of 293.80 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-(piperidin-2-ylmethyl)imidazolidin-2-one is sourced from PubChem (CID 46881463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).