4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide

C11H7Br2ClN2O — CID 107613080

IUPAC4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide
SMILESO=C(Nc1ccc(Br)c(Cl)c1)c1cc(Br)c[nH]1
InChIInChI=1S/C11H7Br2ClN2O/c12-6-3-10(15-5-6)11(17)16-7-1-2-8(13)9(14)4-7/h1-5,15H,(H,16,17)
InChIKeyUERVLBJAIQOYPG-UHFFFAOYSA-N
MW378.45 g/mol
LogP4.45
Rot. Bonds2

About 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide

4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide (PubChem CID 107613080) has the molecular formula C11H7Br2ClN2O and a molecular weight of 378.45 g/mol. Its IUPAC name is 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide
PubChem CID107613080
Molecular FormulaC11H7Br2ClN2O
Molecular Weight378.45 g/mol
Exact Mass375.86
IUPAC Name4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide
SMILESO=C(Nc1ccc(Br)c(Cl)c1)c1cc(Br)c[nH]1
InChIInChI=1S/C11H7Br2ClN2O/c12-6-3-10(15-5-6)11(17)16-7-1-2-8(13)9(14)4-7/h1-5,15H,(H,16,17)
InChIKeyUERVLBJAIQOYPG-UHFFFAOYSA-N
XLogP4.45
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-N-(4-chloro-3-methoxyphenyl)-1H-pyrrole-2-carboxamide
CID 107271771
4-bromo-N-(4-bromo-3-methoxyphenyl)-1H-pyrrole-2-carboxamide
CID 79421457
4-bromo-N-(3-chloro-4-propoxyphenyl)-1H-pyrrole-2-carboxamide
CID 47267908
4-bromo-N-pyridin-4-yl-1H-pyrrole-2-carboxamide
CID 18109255
4-bromo-N-(3-iodo-4-methylphenyl)-1H-pyrrole-2-carboxamide
CID 60667388
4-bromo-N-(2,4,5-trichlorophenyl)-1H-pyrrole-2-carboxamide
CID 43410594
N-(4-bromo-3-chlorophenyl)-4-sulfanylbenzamide
CID 107617517
4-bromo-N-(2,5-dichlorophenyl)-1H-pyrrole-2-carboxamide
CID 43410564
4-bromo-N-(2,4-dichlorophenyl)-1H-pyrrole-2-carboxamide
CID 36679405
2,4-dibromo-N-(4-bromo-3-chlorophenyl)benzamide
CID 114018393
2-[4-[(4-bromo-1H-pyrrole-2-carbonyl)amino]phenyl]acetic acid
CID 28741876
4-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-3,5-dichlorobenzoic acid
CID 82830406

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide?
The IUPAC name of 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide (CID 107613080) is 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide.
What is the SMILES notation for 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide?
The canonical SMILES for 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide is O=C(Nc1ccc(Br)c(Cl)c1)c1cc(Br)c[nH]1.
What is the InChIKey of 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide?
The InChIKey is UERVLBJAIQOYPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Br2ClN2O/c12-6-3-10(15-5-6)11(17)16-7-1-2-8(13)9(14)4-7/h1-5,15H,(H,16,17).
What are the key properties of 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide?
4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide has a molecular weight of 378.45 g/mol, XLogP of 4.45, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(4-bromo-3-chlorophenyl)-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 107613080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).