4-(4-bromophenyl)-1-methylpyrrol-2-amine

C11H11BrN2 — CID 117223205

IUPAC4-(4-bromophenyl)-1-methylpyrrol-2-amine
SMILESCn1cc(-c2ccc(Br)cc2)cc1N
InChIInChI=1S/C11H11BrN2/c1-14-7-9(6-11(14)13)8-2-4-10(12)5-3-8/h2-7H,13H2,1H3
InChIKeyCGAUPZCDDFQDBF-UHFFFAOYSA-N
MW251.13 g/mol
LogP3.04
Rot. Bonds1

About 4-(4-bromophenyl)-1-methylpyrrol-2-amine

4-(4-bromophenyl)-1-methylpyrrol-2-amine (PubChem CID 117223205) has the molecular formula C11H11BrN2 and a molecular weight of 251.13 g/mol. Its IUPAC name is 4-(4-bromophenyl)-1-methylpyrrol-2-amine.

Molecular Properties

Compound Name4-(4-bromophenyl)-1-methylpyrrol-2-amine
PubChem CID117223205
Molecular FormulaC11H11BrN2
Molecular Weight251.13 g/mol
Exact Mass250.01
IUPAC Name4-(4-bromophenyl)-1-methylpyrrol-2-amine
SMILESCn1cc(-c2ccc(Br)cc2)cc1N
InChIInChI=1S/C11H11BrN2/c1-14-7-9(6-11(14)13)8-2-4-10(12)5-3-8/h2-7H,13H2,1H3
InChIKeyCGAUPZCDDFQDBF-UHFFFAOYSA-N
XLogP3.04
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.13
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-bromophenyl)-1-methylpyrrole-2-carbaldehyde
CID 83488779
1-bromo-4-[4-[4-(4-bromophenyl)phenyl]phenyl]benzene
CID 59775505
tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide
CID 173034951
[2-(4-bromophenyl)-1-methylimidazol-4-yl]methanamine
CID 82304335
2-(4-bromophenyl)-1-methylbenzimidazol-5-amine
CID 83969010
3-(4-bromophenyl)-1-(3,5-dimethylphenyl)pyrazol-4-amine
CID 83203402
4-(4-aminophenyl)-N,1-dimethylpyrrole-2-carboxamide
CID 134449881
3-(4-bromophenyl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 82061271
3-(4-bromophenyl)-1-(4-methylphenyl)pyrazol-4-amine
CID 83217202
1-(4-bromophenyl)-3-[4-[4-[3-(4-bromophenyl)-5-(4-phenylphenyl)phenyl]phenyl]phenyl]-5-(4-phenylphenyl)benzene
CID 102428633
6-(4-bromophenyl)-7-methylpyrrolo[3,2-f]quinazoline-1,3-diamine
CID 11383037
3-(4-bromophenyl)-4-methyl-1,2,4-triazole
CID 79014882

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromophenyl)-1-methylpyrrol-2-amine?
The IUPAC name of 4-(4-bromophenyl)-1-methylpyrrol-2-amine (CID 117223205) is 4-(4-bromophenyl)-1-methylpyrrol-2-amine.
What is the SMILES notation for 4-(4-bromophenyl)-1-methylpyrrol-2-amine?
The canonical SMILES for 4-(4-bromophenyl)-1-methylpyrrol-2-amine is Cn1cc(-c2ccc(Br)cc2)cc1N.
What is the InChIKey of 4-(4-bromophenyl)-1-methylpyrrol-2-amine?
The InChIKey is CGAUPZCDDFQDBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2/c1-14-7-9(6-11(14)13)8-2-4-10(12)5-3-8/h2-7H,13H2,1H3.
What are the key properties of 4-(4-bromophenyl)-1-methylpyrrol-2-amine?
4-(4-bromophenyl)-1-methylpyrrol-2-amine has a molecular weight of 251.13 g/mol, XLogP of 3.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromophenyl)-1-methylpyrrol-2-amine is sourced from PubChem (CID 117223205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).