2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one

C15H20ClN3O2 — CID 83268879

IUPAC2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one
SMILESCN1CCOC(CN2C(=O)CNC2c2cccc(Cl)c2)C1
InChIInChI=1S/C15H20ClN3O2/c1-18-5-6-21-13(9-18)10-19-14(20)8-17-15(19)11-3-2-4-12(16)7-11/h2-4,7,13,15,17H,5-6,8-10H2,1H3
InChIKeyLEPUCKXAQASZCI-UHFFFAOYSA-N
MW309.80 g/mol
LogP1.10
Rot. Bonds3

About 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one

2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one (PubChem CID 83268879) has the molecular formula C15H20ClN3O2 and a molecular weight of 309.80 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one.

Molecular Properties

Compound Name2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one
PubChem CID83268879
Molecular FormulaC15H20ClN3O2
Molecular Weight309.80 g/mol
Exact Mass309.12
IUPAC Name2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one
SMILESCN1CCOC(CN2C(=O)CNC2c2cccc(Cl)c2)C1
InChIInChI=1S/C15H20ClN3O2/c1-18-5-6-21-13(9-18)10-19-14(20)8-17-15(19)11-3-2-4-12(16)7-11/h2-4,7,13,15,17H,5-6,8-10H2,1H3
InChIKeyLEPUCKXAQASZCI-UHFFFAOYSA-N
XLogP1.10
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one?
The IUPAC name of 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one (CID 83268879) is 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one.
What is the SMILES notation for 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one?
The canonical SMILES for 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one is CN1CCOC(CN2C(=O)CNC2c2cccc(Cl)c2)C1.
What is the InChIKey of 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one?
The InChIKey is LEPUCKXAQASZCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O2/c1-18-5-6-21-13(9-18)10-19-14(20)8-17-15(19)11-3-2-4-12(16)7-11/h2-4,7,13,15,17H,5-6,8-10H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one?
2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one has a molecular weight of 309.80 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one is sourced from PubChem (CID 83268879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).