2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide

C15H9Br2NO2 — CID 106852301

IUPAC2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide
SMILESO=C(Nc1ccc2cc(Br)ccc2c1)c1ccoc1Br
InChIInChI=1S/C15H9Br2NO2/c16-11-3-1-10-8-12(4-2-9(10)7-11)18-15(19)13-5-6-20-14(13)17/h1-8H,(H,18,19)
InChIKeyNQLMWRUNGDUNRX-UHFFFAOYSA-N
MW395.05 g/mol
LogP5.21
Rot. Bonds2

About 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide

2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide (PubChem CID 106852301) has the molecular formula C15H9Br2NO2 and a molecular weight of 395.05 g/mol. Its IUPAC name is 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide.

Molecular Properties

Compound Name2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide
PubChem CID106852301
Molecular FormulaC15H9Br2NO2
Molecular Weight395.05 g/mol
Exact Mass392.90
IUPAC Name2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide
SMILESO=C(Nc1ccc2cc(Br)ccc2c1)c1ccoc1Br
InChIInChI=1S/C15H9Br2NO2/c16-11-3-1-10-8-12(4-2-9(10)7-11)18-15(19)13-5-6-20-14(13)17/h1-8H,(H,18,19)
InChIKeyNQLMWRUNGDUNRX-UHFFFAOYSA-N
XLogP5.21
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.05
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(2-bromofuran-3-carbonyl)amino]-2-methylbenzoic acid
CID 106851029
2-bromo-N-(3-methylphenyl)furan-3-carboxamide
CID 106852319
4-[(2-bromofuran-3-carbonyl)amino]-2-chlorobenzoic acid
CID 106850976
N-(4-acetylphenyl)-2-bromofuran-3-carboxamide
CID 106852251
2-bromo-N-(4-bromo-2-ethylphenyl)furan-3-carboxamide
CID 106852304
methyl N-[4-[(2-bromofuran-3-carbonyl)amino]phenyl]carbamate
CID 106853285
2-bromo-N-[5-bromo-2-[(E)-N'-hydroxycarbamimidoyl]phenyl]furan-3-carboxamide
CID 107800705
2-bromo-N-thiophen-3-ylfuran-3-carboxamide
CID 106854104
2-bromo-N-[4-methyl-3-(methylsulfamoyl)phenyl]furan-3-carboxamide
CID 106852863
N-(6-bromonaphthalen-2-yl)-5-iodothiophene-3-carboxamide
CID 81259590
2-bromo-N-[4-(2-chloroethyl)phenyl]furan-3-carboxamide
CID 106856118
2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide
CID 106853237

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide?
The IUPAC name of 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide (CID 106852301) is 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide.
What is the SMILES notation for 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide?
The canonical SMILES for 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide is O=C(Nc1ccc2cc(Br)ccc2c1)c1ccoc1Br.
What is the InChIKey of 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide?
The InChIKey is NQLMWRUNGDUNRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Br2NO2/c16-11-3-1-10-8-12(4-2-9(10)7-11)18-15(19)13-5-6-20-14(13)17/h1-8H,(H,18,19).
What are the key properties of 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide?
2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide has a molecular weight of 395.05 g/mol, XLogP of 5.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide is sourced from PubChem (CID 106852301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).