N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide

C15H19Cl2N3O2 — CID 25096465

IUPACN-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide
SMILESCC(C)N1CC(C(=O)NCc2ccc(Cl)cc2Cl)N(C)C1=O
InChIInChI=1S/C15H19Cl2N3O2/c1-9(2)20-8-13(19(3)15(20)22)14(21)18-7-10-4-5-11(16)6-12(10)17/h4-6,9,13H,7-8H2,1-3H3,(H,18,21)
InChIKeyDLDWTIOYZIIOFQ-UHFFFAOYSA-N
MW344.24 g/mol
LogP2.75
Rot. Bonds4

About N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide

N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide (PubChem CID 25096465) has the molecular formula C15H19Cl2N3O2 and a molecular weight of 344.24 g/mol. Its IUPAC name is N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide
PubChem CID25096465
Molecular FormulaC15H19Cl2N3O2
Molecular Weight344.24 g/mol
Exact Mass343.09
IUPAC NameN-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide
SMILESCC(C)N1CC(C(=O)NCc2ccc(Cl)cc2Cl)N(C)C1=O
InChIInChI=1S/C15H19Cl2N3O2/c1-9(2)20-8-13(19(3)15(20)22)14(21)18-7-10-4-5-11(16)6-12(10)17/h4-6,9,13H,7-8H2,1-3H3,(H,18,21)
InChIKeyDLDWTIOYZIIOFQ-UHFFFAOYSA-N
XLogP2.75
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.24
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
The IUPAC name of N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide (CID 25096465) is N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide.
What is the SMILES notation for N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
The canonical SMILES for N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide is CC(C)N1CC(C(=O)NCc2ccc(Cl)cc2Cl)N(C)C1=O.
What is the InChIKey of N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
The InChIKey is DLDWTIOYZIIOFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19Cl2N3O2/c1-9(2)20-8-13(19(3)15(20)22)14(21)18-7-10-4-5-11(16)6-12(10)17/h4-6,9,13H,7-8H2,1-3H3,(H,18,21).
What are the key properties of N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide has a molecular weight of 344.24 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide is sourced from PubChem (CID 25096465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).