5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one

C15H15Cl2NO — CID 54346041

IUPAC5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one
SMILESCC1=C(c2cc(Cl)ccc2Cl)C(=O)NC1(C)C1CC1
InChIInChI=1S/C15H15Cl2NO/c1-8-13(11-7-10(16)5-6-12(11)17)14(19)18-15(8,2)9-3-4-9/h5-7,9H,3-4H2,1-2H3,(H,18,19)
InChIKeyUCJNWGBFFZORIU-UHFFFAOYSA-N
MW296.20 g/mol
LogP4.07
Rot. Bonds2

About 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one

5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one (PubChem CID 54346041) has the molecular formula C15H15Cl2NO and a molecular weight of 296.20 g/mol. Its IUPAC name is 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one.

Molecular Properties

Compound Name5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one
PubChem CID54346041
Molecular FormulaC15H15Cl2NO
Molecular Weight296.20 g/mol
Exact Mass295.05
IUPAC Name5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one
SMILESCC1=C(c2cc(Cl)ccc2Cl)C(=O)NC1(C)C1CC1
InChIInChI=1S/C15H15Cl2NO/c1-8-13(11-7-10(16)5-6-12(11)17)14(19)18-15(8,2)9-3-4-9/h5-7,9H,3-4H2,1-2H3,(H,18,19)
InChIKeyUCJNWGBFFZORIU-UHFFFAOYSA-N
XLogP4.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.20
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-cyclopropyl-3-(2,5-dichlorophenyl)-4-hydroxy-5-methyl-1H-pyrrol-2-one
CID 54721470
5-cyclopropyl-3-(2,5-dichlorophenyl)-5-methylimidazolidine-2,4-dione
CID 106702974
sodium;5-cyclopropyl-4-hydroxy-3-(4-methoxy-2-methylphenyl)-5-methyl-1H-pyrrol-2-one;5-cyclopropyl-3-(4-methoxy-2-methylphenyl)-4,5-dimethyl-1H-pyrrol-2-one;methane;methanol;hydroxide
CID 158636852
1-(5-chloro-2-methylphenyl)-3-cyclopropyl-3-methylpiperazine-2,5-dione
CID 64961466
3-(2,5-dichlorophenyl)-5-methyl-1H-pyridin-2-one
CID 133092464
(4-chloro-2-methylphenyl) 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)acetate
CID 78790836
5-(2,4-dichlorophenyl)-4-methoxy-2,2-dimethyl-1,3-dihydropyridin-6-one
CID 71047590
1-(4-chloro-2-fluorophenyl)-3-cyclopropyl-3,6-dimethylpiperazine-2,5-dione
CID 64965252
1-(4-chloro-3-fluorophenyl)-3-cyclopropyl-3-methylpiperazine-2,5-dione
CID 64964941
1-(2-chloro-5-methylphenyl)-3-cyclopropyl-3-methyl-1,4-diazepane-2,5-dione
CID 107640186
6-chloro-4-cyclopropyl-3,4-dimethyl-1H-quinazolin-2-one;2H-oxete
CID 67873488
4-(2,5-dichlorophenyl)-6-methyl-1H-pyridin-2-one
CID 133092468

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one?
The IUPAC name of 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one (CID 54346041) is 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one.
What is the SMILES notation for 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one?
The canonical SMILES for 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one is CC1=C(c2cc(Cl)ccc2Cl)C(=O)NC1(C)C1CC1.
What is the InChIKey of 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one?
The InChIKey is UCJNWGBFFZORIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO/c1-8-13(11-7-10(16)5-6-12(11)17)14(19)18-15(8,2)9-3-4-9/h5-7,9H,3-4H2,1-2H3,(H,18,19).
What are the key properties of 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one?
5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one has a molecular weight of 296.20 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-3-(2,5-dichlorophenyl)-4,5-dimethyl-1H-pyrrol-2-one is sourced from PubChem (CID 54346041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).