N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide

C13H15Cl2N3O2 — CID 106256841

IUPACN-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide
SMILESCN1CCC(NCC(=O)Nc2c(Cl)cccc2Cl)C1=O
InChIInChI=1S/C13H15Cl2N3O2/c1-18-6-5-10(13(18)20)16-7-11(19)17-12-8(14)3-2-4-9(12)15/h2-4,10,16H,5-7H2,1H3,(H,17,19)
InChIKeyRUFBJZSQAFQJEW-UHFFFAOYSA-N
MW316.19 g/mol
LogP1.75
Rot. Bonds4

About N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide

N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide (PubChem CID 106256841) has the molecular formula C13H15Cl2N3O2 and a molecular weight of 316.19 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide
PubChem CID106256841
Molecular FormulaC13H15Cl2N3O2
Molecular Weight316.19 g/mol
Exact Mass315.05
IUPAC NameN-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide
SMILESCN1CCC(NCC(=O)Nc2c(Cl)cccc2Cl)C1=O
InChIInChI=1S/C13H15Cl2N3O2/c1-18-6-5-10(13(18)20)16-7-11(19)17-12-8(14)3-2-4-9(12)15/h2-4,10,16H,5-7H2,1H3,(H,17,19)
InChIKeyRUFBJZSQAFQJEW-UHFFFAOYSA-N
XLogP1.75
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.19
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dichlorophenyl)-2-[(1-methylpyrrolidin-3-yl)methylamino]acetamide
CID 60855933
N-(2,6-dichlorophenyl)-2-[(1-methylpyrrolidin-2-yl)methylamino]acetamide
CID 106025192
N-(2,6-dichlorophenyl)-2-(oxan-4-ylamino)acetamide
CID 43627352
2-[[(1-methyl-2-oxopyrrolidin-3-yl)amino]methyl]benzoic acid
CID 106257588
N-(2,6-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 2697996
2-(2-cyclopentylethylamino)-N-(2,6-dichlorophenyl)acetamide
CID 60919366
1-methyl-3-(2-methylidenebutylamino)pyrrolidin-2-one
CID 106256749
N-(2,6-dichlorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]acetamide
CID 78960893
1-(6-chloro-8-methylquinolin-5-yl)-3-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]urea
CID 95774160
3-[[2-(2,6-dichloroanilino)-2-oxoethyl]amino]propanamide
CID 43627349
N,N'-bis(2,6-dichlorophenyl)butanediamide
CID 1010966
3-[(2-aminophenyl)methylamino]-1-methylpyrrolidin-2-one
CID 106252839

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide (CID 106256841) is N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide is CN1CCC(NCC(=O)Nc2c(Cl)cccc2Cl)C1=O.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide?
The InChIKey is RUFBJZSQAFQJEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2N3O2/c1-18-6-5-10(13(18)20)16-7-11(19)17-12-8(14)3-2-4-9(12)15/h2-4,10,16H,5-7H2,1H3,(H,17,19).
What are the key properties of N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide?
N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide has a molecular weight of 316.19 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]acetamide is sourced from PubChem (CID 106256841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).