N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide

C11H8BrClN2O2 — CID 81489265

IUPACN-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide
SMILESCc1cc(Br)cnc1NC(=O)c1ccc(Cl)o1
InChIInChI=1S/C11H8BrClN2O2/c1-6-4-7(12)5-14-10(6)15-11(16)8-2-3-9(13)17-8/h2-5H,1H3,(H,14,15,16)
InChIKeyACZLVLHXANXHLD-UHFFFAOYSA-N
MW315.55 g/mol
LogP3.65
Rot. Bonds2

About N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide

N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide (PubChem CID 81489265) has the molecular formula C11H8BrClN2O2 and a molecular weight of 315.55 g/mol. Its IUPAC name is N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide
PubChem CID81489265
Molecular FormulaC11H8BrClN2O2
Molecular Weight315.55 g/mol
Exact Mass313.95
IUPAC NameN-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide
SMILESCc1cc(Br)cnc1NC(=O)c1ccc(Cl)o1
InChIInChI=1S/C11H8BrClN2O2/c1-6-4-7(12)5-14-10(6)15-11(16)8-2-3-9(13)17-8/h2-5H,1H3,(H,14,15,16)
InChIKeyACZLVLHXANXHLD-UHFFFAOYSA-N
XLogP3.65
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.55
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-3-methyl-2-pyridinyl)-4-chloropyridine-3-carboxamide
CID 83166694
N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-4-methylbenzamide
CID 106509648
N-(5-amino-3-methyl-2-pyridinyl)-5-bromofuran-2-carboxamide
CID 112555233
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-hydroxybenzamide
CID 113266660
N-(5-bromo-3-methyl-2-pyridinyl)-5-(4-methoxy-2-nitrophenyl)furan-2-carboxamide
CID 43840692
N-(5-bromo-3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115739184
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-hydrazinylpyridine-3-carboxamide
CID 83170019
N-(5-bromo-3-methyl-2-pyridinyl)-6-oxo-1H-pyrazine-3-carboxamide
CID 83170144
N-(5-bromo-3-methyl-2-pyridinyl)-4-chloro-1-propan-2-ylpyrrole-2-carboxamide
CID 83171095
N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide
CID 83167924
5-chloro-N-(5-methyl-1,2-oxazol-3-yl)furan-2-carboxamide
CID 29494934
N-(5-bromo-3-methyl-2-pyridinyl)-3,6-dimethylpyridazine-4-carboxamide
CID 104670589

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide?
The IUPAC name of N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide (CID 81489265) is N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide.
What is the SMILES notation for N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide?
The canonical SMILES for N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide is Cc1cc(Br)cnc1NC(=O)c1ccc(Cl)o1.
What is the InChIKey of N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide?
The InChIKey is ACZLVLHXANXHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrClN2O2/c1-6-4-7(12)5-14-10(6)15-11(16)8-2-3-9(13)17-8/h2-5H,1H3,(H,14,15,16).
What are the key properties of N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide?
N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide has a molecular weight of 315.55 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide is sourced from PubChem (CID 81489265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).