1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide

C10H9Cl2N3O2 — CID 168698108

IUPAC1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ncc(Cl)cc2Cl)C1
InChIInChI=1S/C10H9Cl2N3O2/c11-6-2-7(12)10(14-3-6)15-4-5(9(13)17)1-8(15)16/h2-3,5H,1,4H2,(H2,13,17)
InChIKeyUJZOCXKFZAOERC-UHFFFAOYSA-N
MW274.11 g/mol
LogP1.23
Rot. Bonds2

About 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide

1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 168698108) has the molecular formula C10H9Cl2N3O2 and a molecular weight of 274.11 g/mol. Its IUPAC name is 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID168698108
Molecular FormulaC10H9Cl2N3O2
Molecular Weight274.11 g/mol
Exact Mass273.01
IUPAC Name1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ncc(Cl)cc2Cl)C1
InChIInChI=1S/C10H9Cl2N3O2/c11-6-2-7(12)10(14-3-6)15-4-5(9(13)17)1-8(15)16/h2-3,5H,1,4H2,(H2,13,17)
InChIKeyUJZOCXKFZAOERC-UHFFFAOYSA-N
XLogP1.23
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.11
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-bromo-5-chloro-3-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168698278
1-(3,5-dimethyl-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168696816
1-(3-amino-5-bromopyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 168698071
1-(2-amino-3,5-dichlorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168698272
1-(5-bromo-3-fluoro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168697582
1-(4-amino-3,5-dichlorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168697901
1-(5-bromo-3-cyano-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168697511
1-(2,6-dichloropyrimidin-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 168698527
1-[3-bromo-5-(trifluoromethyl)-2-pyridinyl]-5-oxopyrrolidine-3-carboxamide
CID 168698103
methyl 1-(3-bromo-5-chloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxylate
CID 168694987
1-(3,5-dichloro-4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168697899
1-(5-bromopyrimidin-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 168698124

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide (CID 168698108) is 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide is NC(=O)C1CC(=O)N(c2ncc(Cl)cc2Cl)C1.
What is the InChIKey of 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is UJZOCXKFZAOERC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2N3O2/c11-6-2-7(12)10(14-3-6)15-4-5(9(13)17)1-8(15)16/h2-3,5H,1,4H2,(H2,13,17).
What are the key properties of 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide?
1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 274.11 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 168698108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).