(2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide

C11H10Cl2N2O3 — CID 103891199

IUPAC(2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide
SMILESO=C1CC[C@H](C(=O)Nc2cc(Cl)cc(Cl)c2O)N1
InChIInChI=1S/C11H10Cl2N2O3/c12-5-3-6(13)10(17)8(4-5)15-11(18)7-1-2-9(16)14-7/h3-4,7,17H,1-2H2,(H,14,16)(H,15,18)/t7-/m1/s1
InChIKeyNOZVNTLOSIMHBS-SSDOTTSWSA-N
MW289.12 g/mol
LogP1.92
Rot. Bonds2

About (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide

(2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 103891199) has the molecular formula C11H10Cl2N2O3 and a molecular weight of 289.12 g/mol. Its IUPAC name is (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide
PubChem CID103891199
Molecular FormulaC11H10Cl2N2O3
Molecular Weight289.12 g/mol
Exact Mass288.01
IUPAC Name(2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide
SMILESO=C1CC[C@H](C(=O)Nc2cc(Cl)cc(Cl)c2O)N1
InChIInChI=1S/C11H10Cl2N2O3/c12-5-3-6(13)10(17)8(4-5)15-11(18)7-1-2-9(16)14-7/h3-4,7,17H,1-2H2,(H,14,16)(H,15,18)/t7-/m1/s1
InChIKeyNOZVNTLOSIMHBS-SSDOTTSWSA-N
XLogP1.92
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.12
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

(2S)-N-(3,5-dichlorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 26469933
(2R)-N-(5-chloro-2-methoxyphenyl)-5-oxopyrrolidine-2-carboxamide
CID 95271416
N-(3-chloro-4-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide
CID 64787520
N-(3,5-dichloro-2-hydroxyphenyl)-2-methylcyclopropane-1-carboxamide
CID 103891112
N-(3,5-dichloro-2-hydroxyphenyl)thiolane-3-carboxamide
CID 104625878
2-hydroxy-3-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]benzoic acid
CID 114039518
(2R)-N-(4-bromo-3-chlorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 103824880
N-(4-bromo-3-chlorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 103824877
(2S)-N-(3-bromo-4-chlorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 675422
3,6-dichloro-2-[(5-oxopyrrolidine-2-carbonyl)amino]benzoic acid
CID 107048504
(2S)-N-[(2,4-dichlorophenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 132530671
N-(4,5-dimethoxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide
CID 110792994

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide (CID 103891199) is (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide is O=C1CC[C@H](C(=O)Nc2cc(Cl)cc(Cl)c2O)N1.
What is the InChIKey of (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is NOZVNTLOSIMHBS-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H10Cl2N2O3/c12-5-3-6(13)10(17)8(4-5)15-11(18)7-1-2-9(16)14-7/h3-4,7,17H,1-2H2,(H,14,16)(H,15,18)/t7-/m1/s1.
What are the key properties of (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide?
(2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 289.12 g/mol, XLogP of 1.92, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3,5-dichloro-2-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 103891199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).