4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide

C8H3Cl3N4O2 — CID 10193046

IUPAC4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide
SMILESO=C(Nc1cnc(Cl)nc1)c1nc(Cl)c(Cl)o1
InChIInChI=1S/C8H3Cl3N4O2/c9-4-5(10)17-7(15-4)6(16)14-3-1-12-8(11)13-2-3/h1-2H,(H,14,16)
InChIKeyPABOWDIBQSWCLW-UHFFFAOYSA-N
MW293.50 g/mol
LogP2.68
Rot. Bonds2

About 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide

4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide (PubChem CID 10193046) has the molecular formula C8H3Cl3N4O2 and a molecular weight of 293.50 g/mol. Its IUPAC name is 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide.

Molecular Properties

Compound Name4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide
PubChem CID10193046
Molecular FormulaC8H3Cl3N4O2
Molecular Weight293.50 g/mol
Exact Mass291.93
IUPAC Name4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide
SMILESO=C(Nc1cnc(Cl)nc1)c1nc(Cl)c(Cl)o1
InChIInChI=1S/C8H3Cl3N4O2/c9-4-5(10)17-7(15-4)6(16)14-3-1-12-8(11)13-2-3/h1-2H,(H,14,16)
InChIKeyPABOWDIBQSWCLW-UHFFFAOYSA-N
XLogP2.68
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-thiazole-2-carboxamide
CID 10236586
6-chloro-N-(2-chloropyrimidin-5-yl)pyridine-3-carboxamide
CID 10125350
5-chloro-N-(2-chloropyrimidin-5-yl)-2-hydroxybenzamide
CID 121352747
N-(2-chloropyrimidin-5-yl)-1H-imidazole-2-carboxamide
CID 10171378
(2,4-dichloropyrimidin-5-yl)carbamic acid
CID 118393438
2,6-dichloro-N-(2,4-dichloropyrimidin-5-yl)benzamide
CID 169100604
N-(2-chloropyrimidin-5-yl)-3-fluoro-4-propan-2-ylsulfanylbenzamide
CID 58845177
6-chloro-N-(6-chloro-3-pyridinyl)pyrazine-2-carboxamide
CID 103186985
N-(5-bromo-6-chloro-3-pyridinyl)-4-methylbenzamide
CID 113267904
4,5-dichloro-N-(6-chloro-3-pyridinyl)-1H-imidazole-2-carboxamide
CID 23592282
2,4-dichloro-N-(2,6-dichloro-4-fluorophenyl)pyrimidine-5-carboxamide
CID 171834809
1-(2-chloro-5-methylphenyl)-3-(2-chloropyrimidin-5-yl)urea;methane
CID 167695271

Frequently Asked Questions

What is the IUPAC name of 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide?
The IUPAC name of 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide (CID 10193046) is 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide.
What is the SMILES notation for 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide?
The canonical SMILES for 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide is O=C(Nc1cnc(Cl)nc1)c1nc(Cl)c(Cl)o1.
What is the InChIKey of 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide?
The InChIKey is PABOWDIBQSWCLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3Cl3N4O2/c9-4-5(10)17-7(15-4)6(16)14-3-1-12-8(11)13-2-3/h1-2H,(H,14,16).
What are the key properties of 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide?
4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide has a molecular weight of 293.50 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dichloro-N-(2-chloropyrimidin-5-yl)-1,3-oxazole-2-carboxamide is sourced from PubChem (CID 10193046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).