N-(3-bromophenyl)-1-benzofuran-2-carboxamide

C15H10BrNO2 — CID 802478

IUPACN-(3-bromophenyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1cccc(Br)c1)c1cc2ccccc2o1
InChIInChI=1S/C15H10BrNO2/c16-11-5-3-6-12(9-11)17-15(18)14-8-10-4-1-2-7-13(10)19-14/h1-9H,(H,17,18)
InChIKeyQXXJKCVHFOPREC-UHFFFAOYSA-N
MW316.15 g/mol
LogP4.45
Rot. Bonds2

About N-(3-bromophenyl)-1-benzofuran-2-carboxamide

N-(3-bromophenyl)-1-benzofuran-2-carboxamide (PubChem CID 802478) has the molecular formula C15H10BrNO2 and a molecular weight of 316.15 g/mol. Its IUPAC name is N-(3-bromophenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-1-benzofuran-2-carboxamide
PubChem CID802478
Molecular FormulaC15H10BrNO2
Molecular Weight316.15 g/mol
Exact Mass314.99
IUPAC NameN-(3-bromophenyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1cccc(Br)c1)c1cc2ccccc2o1
InChIInChI=1S/C15H10BrNO2/c16-11-5-3-6-12(9-11)17-15(18)14-8-10-4-1-2-7-13(10)19-14/h1-9H,(H,17,18)
InChIKeyQXXJKCVHFOPREC-UHFFFAOYSA-N
XLogP4.45
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.15
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[(3-bromobenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide
CID 17112130
N-(3-bromophenyl)-5-methoxy-1-benzofuran-2-carboxamide
CID 51432230
N-[4-[2-[(3-bromophenyl)methylamino]-2-oxoethyl]phenyl]-1-benzofuran-2-carboxamide
CID 60571787
N-[3-[(3-chlorobenzoyl)amino]phenyl]-1-benzofuran-2-carboxamide
CID 1136389
N-[3-[(4-tert-butylbenzoyl)amino]phenyl]-1-benzofuran-2-carboxamide
CID 22775944
N-[3-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide
CID 1232080
N-[3-[(2-bromobenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide
CID 17112122
N-(4-iodophenyl)-1-benzofuran-2-carboxamide
CID 986281
N-[3-[(2-cyanoacetyl)amino]phenyl]-1-benzofuran-2-carboxamide
CID 168521643
N-(3-amino-4-chlorophenyl)-1-benzofuran-2-carboxamide
CID 24708217
N-(4-bromo-2-ethylphenyl)-1-benzofuran-2-carboxamide
CID 80999240
5-bromo-N-[3-(difluoromethoxy)phenyl]-1-benzofuran-2-carboxamide
CID 55782296

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(3-bromophenyl)-1-benzofuran-2-carboxamide (CID 802478) is N-(3-bromophenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(3-bromophenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(3-bromophenyl)-1-benzofuran-2-carboxamide is O=C(Nc1cccc(Br)c1)c1cc2ccccc2o1.
What is the InChIKey of N-(3-bromophenyl)-1-benzofuran-2-carboxamide?
The InChIKey is QXXJKCVHFOPREC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrNO2/c16-11-5-3-6-12(9-11)17-15(18)14-8-10-4-1-2-7-13(10)19-14/h1-9H,(H,17,18).
What are the key properties of N-(3-bromophenyl)-1-benzofuran-2-carboxamide?
N-(3-bromophenyl)-1-benzofuran-2-carboxamide has a molecular weight of 316.15 g/mol, XLogP of 4.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromophenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 802478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).