N-(4-bromo-2-pyridinyl)furan-2-carboxamide

C10H7BrN2O2 — CID 102674239

IUPACN-(4-bromo-2-pyridinyl)furan-2-carboxamide
SMILESO=C(Nc1cc(Br)ccn1)c1ccco1
InChIInChI=1S/C10H7BrN2O2/c11-7-3-4-12-9(6-7)13-10(14)8-2-1-5-15-8/h1-6H,(H,12,13,14)
InChIKeyQXBDQNQLKKHKIQ-UHFFFAOYSA-N
MW267.08 g/mol
LogP2.69
Rot. Bonds2

About N-(4-bromo-2-pyridinyl)furan-2-carboxamide

N-(4-bromo-2-pyridinyl)furan-2-carboxamide (PubChem CID 102674239) has the molecular formula C10H7BrN2O2 and a molecular weight of 267.08 g/mol. Its IUPAC name is N-(4-bromo-2-pyridinyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2-pyridinyl)furan-2-carboxamide
PubChem CID102674239
Molecular FormulaC10H7BrN2O2
Molecular Weight267.08 g/mol
Exact Mass265.97
IUPAC NameN-(4-bromo-2-pyridinyl)furan-2-carboxamide
SMILESO=C(Nc1cc(Br)ccn1)c1ccco1
InChIInChI=1S/C10H7BrN2O2/c11-7-3-4-12-9(6-7)13-10(14)8-2-1-5-15-8/h1-6H,(H,12,13,14)
InChIKeyQXBDQNQLKKHKIQ-UHFFFAOYSA-N
XLogP2.69
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.08
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-pyridinyl)furan-2-carboxamide?
The IUPAC name of N-(4-bromo-2-pyridinyl)furan-2-carboxamide (CID 102674239) is N-(4-bromo-2-pyridinyl)furan-2-carboxamide.
What is the SMILES notation for N-(4-bromo-2-pyridinyl)furan-2-carboxamide?
The canonical SMILES for N-(4-bromo-2-pyridinyl)furan-2-carboxamide is O=C(Nc1cc(Br)ccn1)c1ccco1.
What is the InChIKey of N-(4-bromo-2-pyridinyl)furan-2-carboxamide?
The InChIKey is QXBDQNQLKKHKIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrN2O2/c11-7-3-4-12-9(6-7)13-10(14)8-2-1-5-15-8/h1-6H,(H,12,13,14).
What are the key properties of N-(4-bromo-2-pyridinyl)furan-2-carboxamide?
N-(4-bromo-2-pyridinyl)furan-2-carboxamide has a molecular weight of 267.08 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-pyridinyl)furan-2-carboxamide is sourced from PubChem (CID 102674239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).