N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide

C10H9ClF3N3O3 — CID 51074834

IUPACN-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide
SMILESNC(=O)NC(=O)CCn1cc(C(F)(F)F)cc(Cl)c1=O
InChIInChI=1S/C10H9ClF3N3O3/c11-6-3-5(10(12,13)14)4-17(8(6)19)2-1-7(18)16-9(15)20/h3-4H,1-2H2,(H3,15,16,18,20)
InChIKeyOQTHLCHSKIQFAD-UHFFFAOYSA-N
MW311.65 g/mol
LogP1.11
Rot. Bonds3

About N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide

N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide (PubChem CID 51074834) has the molecular formula C10H9ClF3N3O3 and a molecular weight of 311.65 g/mol. Its IUPAC name is N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide.

Molecular Properties

Compound NameN-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide
PubChem CID51074834
Molecular FormulaC10H9ClF3N3O3
Molecular Weight311.65 g/mol
Exact Mass311.03
IUPAC NameN-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide
SMILESNC(=O)NC(=O)CCn1cc(C(F)(F)F)cc(Cl)c1=O
InChIInChI=1S/C10H9ClF3N3O3/c11-6-3-5(10(12,13)14)4-17(8(6)19)2-1-7(18)16-9(15)20/h3-4H,1-2H2,(H3,15,16,18,20)
InChIKeyOQTHLCHSKIQFAD-UHFFFAOYSA-N
XLogP1.11
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.65
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanoate
CID 71606958
N-tert-butyl-2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 2587466
3-chloro-1-(2-oxopropyl)-5-(trifluoromethyl)pyridin-2-one
CID 8894290
2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]-N-(2,4,6-trichlorophenyl)acetamide
CID 2445579
1-(2-amino-2-methylpropyl)-3-chloro-5-(trifluoromethyl)pyridin-2-one
CID 82144141
2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
CID 2099437
2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]-N-naphthalen-1-ylacetamide
CID 2097457
2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]-N-(2,5-dimethylpyrazol-3-yl)acetamide
CID 24566356
N-(4-tert-butylphenyl)-2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 7183544
3-chloro-5-(trifluoromethyl)-1-(trimethylsilylmethyl)pyridin-2-one
CID 56570581
N-(benzylcarbamoyl)-2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 5181987
(2R)-3-amino-2-[2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetyl]but-3-enenitrile
CID 2394145

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide?
The IUPAC name of N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide (CID 51074834) is N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide.
What is the SMILES notation for N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide?
The canonical SMILES for N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide is NC(=O)NC(=O)CCn1cc(C(F)(F)F)cc(Cl)c1=O.
What is the InChIKey of N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide?
The InChIKey is OQTHLCHSKIQFAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClF3N3O3/c11-6-3-5(10(12,13)14)4-17(8(6)19)2-1-7(18)16-9(15)20/h3-4H,1-2H2,(H3,15,16,18,20).
What are the key properties of N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide?
N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide has a molecular weight of 311.65 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-3-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]propanamide is sourced from PubChem (CID 51074834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).