2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine

C11H12BrN3 — CID 83902451

IUPAC2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine
SMILESNCCc1ccnn1-c1ccccc1Br
InChIInChI=1S/C11H12BrN3/c12-10-3-1-2-4-11(10)15-9(5-7-13)6-8-14-15/h1-4,6,8H,5,7,13H2
InChIKeyNHOYQTMZWQYGPM-UHFFFAOYSA-N
MW266.14 g/mol
LogP2.14
Rot. Bonds3

About 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine

2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine (PubChem CID 83902451) has the molecular formula C11H12BrN3 and a molecular weight of 266.14 g/mol. Its IUPAC name is 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine
PubChem CID83902451
Molecular FormulaC11H12BrN3
Molecular Weight266.14 g/mol
Exact Mass265.02
IUPAC Name2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine
SMILESNCCc1ccnn1-c1ccccc1Br
InChIInChI=1S/C11H12BrN3/c12-10-3-1-2-4-11(10)15-9(5-7-13)6-8-14-15/h1-4,6,8H,5,7,13H2
InChIKeyNHOYQTMZWQYGPM-UHFFFAOYSA-N
XLogP2.14
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.14
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-bromophenyl)pyrazol-3-yl]acetic acid
CID 83904762
2-[1-(2-bromophenyl)-5-methyl-1,2,4-triazol-3-yl]ethanamine
CID 82489373
4-(3-aminopropyl)-1-(2-bromophenyl)pyrazol-5-amine
CID 115069448
2-[1-(2-bromophenyl)-5-methoxy-3-methylpyrazol-4-yl]ethanamine
CID 117123584
[1-(2-bromophenyl)-5-methylpyrazol-3-yl]methanamine
CID 82091921
[2-(2-methoxyphenyl)pyrazol-3-yl]methanamine
CID 83881539
3-[1-(2-bromophenyl)-3,5-dimethylpyrazol-4-yl]propan-1-amine
CID 79224848
2-[1-(2-bromophenyl)pyrrol-3-yl]ethanamine
CID 82304023
[5-bromo-1-(2-bromophenyl)pyrazol-4-yl]methanol
CID 77174643
[1-(2-bromophenyl)-5-methoxypyrazol-4-yl]methanamine
CID 115006431
1-[2-(2-fluorophenyl)pyrazol-3-yl]-N-methylmethanamine
CID 83882394
1-(2-bromophenyl)-5-chloropyrazol-4-amine
CID 115050693

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine?
The IUPAC name of 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine (CID 83902451) is 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine.
What is the SMILES notation for 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine?
The canonical SMILES for 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine is NCCc1ccnn1-c1ccccc1Br.
What is the InChIKey of 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine?
The InChIKey is NHOYQTMZWQYGPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrN3/c12-10-3-1-2-4-11(10)15-9(5-7-13)6-8-14-15/h1-4,6,8H,5,7,13H2.
What are the key properties of 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine?
2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine has a molecular weight of 266.14 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-bromophenyl)pyrazol-3-yl]ethanamine is sourced from PubChem (CID 83902451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).