3-(2,3-dibromophenyl)pyrrolidin-3-ol

C10H11Br2NO — CID 117103979

IUPAC3-(2,3-dibromophenyl)pyrrolidin-3-ol
SMILESOC1(c2cccc(Br)c2Br)CCNC1
InChIInChI=1S/C10H11Br2NO/c11-8-3-1-2-7(9(8)12)10(14)4-5-13-6-10/h1-3,13-14H,4-6H2
InChIKeyGVQVJTLCDXRFLG-UHFFFAOYSA-N
MW321.01 g/mol
LogP2.39
Rot. Bonds1

About 3-(2,3-dibromophenyl)pyrrolidin-3-ol

3-(2,3-dibromophenyl)pyrrolidin-3-ol (PubChem CID 117103979) has the molecular formula C10H11Br2NO and a molecular weight of 321.01 g/mol. Its IUPAC name is 3-(2,3-dibromophenyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name3-(2,3-dibromophenyl)pyrrolidin-3-ol
PubChem CID117103979
Molecular FormulaC10H11Br2NO
Molecular Weight321.01 g/mol
Exact Mass318.92
IUPAC Name3-(2,3-dibromophenyl)pyrrolidin-3-ol
SMILESOC1(c2cccc(Br)c2Br)CCNC1
InChIInChI=1S/C10H11Br2NO/c11-8-3-1-2-7(9(8)12)10(14)4-5-13-6-10/h1-3,13-14H,4-6H2
InChIKeyGVQVJTLCDXRFLG-UHFFFAOYSA-N
XLogP2.39
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.01
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-bromo-6-hydroxyphenyl)pyrrolidin-3-ol
CID 117103918
3-(2-chloro-3-hydroxyphenyl)pyrrolidin-3-ol
CID 117103973
3-(2-bromo-4-chlorophenyl)pyrrolidin-3-ol
CID 117103961
3-(3-bromo-2-fluorophenyl)azetidin-3-ol
CID 106644465
3-(5-bromo-2-chlorophenyl)pyrrolidin-3-ol
CID 117103942
3-(5-bromo-2-fluorophenyl)pyrrolidin-3-ol
CID 79743506
(3R)-3-phenylpyrrolidin-3-ol;hydrochloride
CID 154574670
3-(2-bromophenyl)-3-methylpyrrolidine
CID 62354169
3-[2-(2-methoxyethoxy)phenyl]pyrrolidin-3-ol
CID 113438129
3-(2-bromo-5-chlorophenyl)piperidin-3-ol
CID 117103863
3-(2-amino-6-chlorophenyl)pyrrolidin-3-ol
CID 117103678
3-(2-chloro-4-methylphenyl)pyrrolidin-3-ol
CID 117103965

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dibromophenyl)pyrrolidin-3-ol?
The IUPAC name of 3-(2,3-dibromophenyl)pyrrolidin-3-ol (CID 117103979) is 3-(2,3-dibromophenyl)pyrrolidin-3-ol.
What is the SMILES notation for 3-(2,3-dibromophenyl)pyrrolidin-3-ol?
The canonical SMILES for 3-(2,3-dibromophenyl)pyrrolidin-3-ol is OC1(c2cccc(Br)c2Br)CCNC1.
What is the InChIKey of 3-(2,3-dibromophenyl)pyrrolidin-3-ol?
The InChIKey is GVQVJTLCDXRFLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Br2NO/c11-8-3-1-2-7(9(8)12)10(14)4-5-13-6-10/h1-3,13-14H,4-6H2.
What are the key properties of 3-(2,3-dibromophenyl)pyrrolidin-3-ol?
3-(2,3-dibromophenyl)pyrrolidin-3-ol has a molecular weight of 321.01 g/mol, XLogP of 2.39, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dibromophenyl)pyrrolidin-3-ol is sourced from PubChem (CID 117103979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).