5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide

C11H14BrNO2 — CID 130978943

IUPAC5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide
SMILESCCC1(NC(=O)c2coc(Br)c2)CCC1
InChIInChI=1S/C11H14BrNO2/c1-2-11(4-3-5-11)13-10(14)8-6-9(12)15-7-8/h6-7H,2-5H2,1H3,(H,13,14)
InChIKeyBNOLJIPQEHDTDK-UHFFFAOYSA-N
MW272.14 g/mol
LogP3.10
Rot. Bonds3

About 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide

5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide (PubChem CID 130978943) has the molecular formula C11H14BrNO2 and a molecular weight of 272.14 g/mol. Its IUPAC name is 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide
PubChem CID130978943
Molecular FormulaC11H14BrNO2
Molecular Weight272.14 g/mol
Exact Mass271.02
IUPAC Name5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide
SMILESCCC1(NC(=O)c2coc(Br)c2)CCC1
InChIInChI=1S/C11H14BrNO2/c1-2-11(4-3-5-11)13-10(14)8-6-9(12)15-7-8/h6-7H,2-5H2,1H3,(H,13,14)
InChIKeyBNOLJIPQEHDTDK-UHFFFAOYSA-N
XLogP3.10
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.14
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-[(5-bromofuran-3-carbonyl)amino]cyclohexyl]acetic acid
CID 75513389
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CID 107980571
4-bromo-N-(1-ethylcyclobutyl)-3-hydroxybenzamide
CID 113358588
3-bromo-N-(1-ethylcyclobutyl)-4-methylbenzamide
CID 115673069
N-(2-amino-2-methylpropyl)-5-bromofuran-3-carboxamide
CID 119627230
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CID 131025860
5-bromo-N-[1-(1H-1,2,4-triazol-5-yl)cyclobutyl]furan-3-carboxamide
CID 99841002
3-amino-N-(1-ethylcyclobutyl)-5-fluorobenzamide
CID 113488542
3-amino-N-(1-ethylcyclobutyl)-4-methylbenzamide
CID 113266948
3-[(1-ethylcyclobutyl)carbamoyl]-1,2-oxazole-5-carboxylic acid
CID 107369989
N-(1-ethylcyclobutyl)-3-fluoro-4-nitrobenzamide
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CID 114559748

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide?
The IUPAC name of 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide (CID 130978943) is 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide?
The canonical SMILES for 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide is CCC1(NC(=O)c2coc(Br)c2)CCC1.
What is the InChIKey of 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide?
The InChIKey is BNOLJIPQEHDTDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrNO2/c1-2-11(4-3-5-11)13-10(14)8-6-9(12)15-7-8/h6-7H,2-5H2,1H3,(H,13,14).
What are the key properties of 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide?
5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide has a molecular weight of 272.14 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(1-ethylcyclobutyl)furan-3-carboxamide is sourced from PubChem (CID 130978943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).