1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea

C10H8BrN3O2 — CID 108868656

IUPAC1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea
SMILESO=C(Nc1ccc(Br)cn1)Nc1ccco1
InChIInChI=1S/C10H8BrN3O2/c11-7-3-4-8(12-6-7)13-10(15)14-9-2-1-5-16-9/h1-6H,(H2,12,13,14,15)
InChIKeyOUFFDZHCIVAMLB-UHFFFAOYSA-N
MW282.10 g/mol
LogP3.08
Rot. Bonds2

About 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea

1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea (PubChem CID 108868656) has the molecular formula C10H8BrN3O2 and a molecular weight of 282.10 g/mol. Its IUPAC name is 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea.

Molecular Properties

Compound Name1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea
PubChem CID108868656
Molecular FormulaC10H8BrN3O2
Molecular Weight282.10 g/mol
Exact Mass280.98
IUPAC Name1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea
SMILESO=C(Nc1ccc(Br)cn1)Nc1ccco1
InChIInChI=1S/C10H8BrN3O2/c11-7-3-4-8(12-6-7)13-10(15)14-9-2-1-5-16-9/h1-6H,(H2,12,13,14,15)
InChIKeyOUFFDZHCIVAMLB-UHFFFAOYSA-N
XLogP3.08
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.10
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-bromo-2-pyridinyl)-3-(furan-2-yl)urea
CID 108868659
1-(5-bromo-2-pyridinyl)-3-(1,2-oxazol-5-yl)urea
CID 108814254
1-(5-bromo-2-pyridinyl)-3-thiophen-2-ylurea
CID 20886027
1-(4-aminophenyl)-3-(5-bromo-2-pyridinyl)urea
CID 108897086
1-(5-bromo-2-pyridinyl)-3-ethenylurea
CID 108909365
N-(5-bromo-2-pyridinyl)-2-methylpropanamide
CID 14988412
1-(5-bromo-2-pyridinyl)-3-prop-1-en-2-ylurea
CID 108910477
1-(5-bromo-2-pyridinyl)-3-(4-methylsulfanylphenyl)urea
CID 4525205
2-(4-bromophenyl)-N-(5-bromo-2-pyridinyl)acetamide
CID 29260244
2-bromo-N-(5-bromo-2-pyridinyl)-3-methylbutanamide
CID 43114357
2-amino-N-(5-bromo-2-pyridinyl)benzamide
CID 13348356
5-bromo-N-(furan-2-ylmethyl)pyridin-2-amine
CID 28541636

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea?
The IUPAC name of 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea (CID 108868656) is 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea.
What is the SMILES notation for 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea?
The canonical SMILES for 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea is O=C(Nc1ccc(Br)cn1)Nc1ccco1.
What is the InChIKey of 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea?
The InChIKey is OUFFDZHCIVAMLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3O2/c11-7-3-4-8(12-6-7)13-10(15)14-9-2-1-5-16-9/h1-6H,(H2,12,13,14,15).
What are the key properties of 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea?
1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea has a molecular weight of 282.10 g/mol, XLogP of 3.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-pyridinyl)-3-(furan-2-yl)urea is sourced from PubChem (CID 108868656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).