N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide

C18H15Cl2NO3 — CID 134103282

IUPACN-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide
SMILESCC1(c2ccccc2)OC(=O)CC1C(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C18H15Cl2NO3/c1-18(11-5-3-2-4-6-11)13(10-16(22)24-18)17(23)21-12-7-8-14(19)15(20)9-12/h2-9,13H,10H2,1H3,(H,21,23)
InChIKeyACNUNGXESLRHAB-UHFFFAOYSA-N
MW364.23 g/mol
LogP4.41
Rot. Bonds3

About N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide

N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide (PubChem CID 134103282) has the molecular formula C18H15Cl2NO3 and a molecular weight of 364.23 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide
PubChem CID134103282
Molecular FormulaC18H15Cl2NO3
Molecular Weight364.23 g/mol
Exact Mass363.04
IUPAC NameN-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide
SMILESCC1(c2ccccc2)OC(=O)CC1C(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C18H15Cl2NO3/c1-18(11-5-3-2-4-6-11)13(10-16(22)24-18)17(23)21-12-7-8-14(19)15(20)9-12/h2-9,13H,10H2,1H3,(H,21,23)
InChIKeyACNUNGXESLRHAB-UHFFFAOYSA-N
XLogP4.41
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.23
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4R,5S)-N-(3,4-dichlorophenyl)-7,7-dimethyl-2-oxo-1,8-dioxaspiro[4.5]decane-4-carboxamide
CID 1267467
methyl (2S,3R)-2-methyl-5-oxo-2-phenyloxolane-3-carboxylate
CID 102364670
(3S)-2,2-dimethyl-5-oxo-N-phenyloxolane-3-carboxamide
CID 929902
cis-(1S,3S)-3-[(3,4-dichlorophenyl)carbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylate
CID 7446495
(1S)-2,2-dichloro-N-(3,4-dichlorophenyl)-1-phenylcyclopropane-1-carboxamide
CID 7039242
(1R)-2,2-dichloro-N-(3,4-dichlorophenyl)-1-phenylcyclopropane-1-carboxamide
CID 7039241
(2S)-N-(3,4-dichlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 9071678
4-acetyl-N-(3,4-dichlorophenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide
CID 43029722
N-(3-methylphenyl)-2-oxo-1-oxaspiro[4.4]nonane-4-carboxamide
CID 2956170
4-amino-N-(3,4-dichlorophenyl)cyclopent-2-ene-1-carboxamide
CID 79210508
N-(3,4-dichlorophenyl)-6-methyl-1-oxo-3,4-dihydroisochromene-3-carboxamide
CID 4870540
1-N-(2-chlorophenyl)-2-N-(3,4-dichlorophenyl)cyclopropane-1,2-dicarboxamide
CID 109142847

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide (CID 134103282) is N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide is CC1(c2ccccc2)OC(=O)CC1C(=O)Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide?
The InChIKey is ACNUNGXESLRHAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2NO3/c1-18(11-5-3-2-4-6-11)13(10-16(22)24-18)17(23)21-12-7-8-14(19)15(20)9-12/h2-9,13H,10H2,1H3,(H,21,23).
What are the key properties of N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide?
N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide has a molecular weight of 364.23 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-methyl-5-oxo-2-phenyloxolane-3-carboxamide is sourced from PubChem (CID 134103282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).