6-[(2,5-dibromoanilino)methyl]pyridin-3-ol

C12H10Br2N2O — CID 79782859

IUPAC6-[(2,5-dibromoanilino)methyl]pyridin-3-ol
SMILESOc1ccc(CNc2cc(Br)ccc2Br)nc1
InChIInChI=1S/C12H10Br2N2O/c13-8-1-4-11(14)12(5-8)16-6-9-2-3-10(17)7-15-9/h1-5,7,16-17H,6H2
InChIKeyDWMGSKAVVTUZSG-UHFFFAOYSA-N
MW358.03 g/mol
LogP3.92
Rot. Bonds3

About 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol

6-[(2,5-dibromoanilino)methyl]pyridin-3-ol (PubChem CID 79782859) has the molecular formula C12H10Br2N2O and a molecular weight of 358.03 g/mol. Its IUPAC name is 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[(2,5-dibromoanilino)methyl]pyridin-3-ol
PubChem CID79782859
Molecular FormulaC12H10Br2N2O
Molecular Weight358.03 g/mol
Exact Mass355.92
IUPAC Name6-[(2,5-dibromoanilino)methyl]pyridin-3-ol
SMILESOc1ccc(CNc2cc(Br)ccc2Br)nc1
InChIInChI=1S/C12H10Br2N2O/c13-8-1-4-11(14)12(5-8)16-6-9-2-3-10(17)7-15-9/h1-5,7,16-17H,6H2
InChIKeyDWMGSKAVVTUZSG-UHFFFAOYSA-N
XLogP3.92
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.03
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(5-bromo-2-methoxyanilino)methyl]pyridin-3-ol
CID 79783055
2,5-dibromo-N-(pyridin-2-ylmethyl)aniline
CID 43736724
2,5-dibromo-N-(quinoxalin-2-ylmethyl)aniline
CID 43789270
3-bromo-4-[(5-hydroxy-2-pyridinyl)methylamino]benzenesulfonamide
CID 79783627
6-[(2-bromo-4-methyl-5-nitroanilino)methyl]pyridin-3-ol
CID 104815034
6-[(2,3,4-trifluoroanilino)methyl]pyridin-3-ol
CID 79775562
6-[[2-(4-bromophenyl)propan-2-ylamino]methyl]pyridin-3-ol
CID 79784008
6-[(2-fluoro-5-methylanilino)methyl]pyridin-3-ol
CID 79776132
6-(anilinomethyl)pyridin-3-ol
CID 79787965
2,5-dibromo-N-(1,3-thiazol-2-ylmethyl)aniline
CID 63656219
6-[(2-methoxy-4-methylanilino)methyl]pyridin-3-ol
CID 79782889
6-[(2,4-dimethoxyanilino)methyl]pyridin-3-ol
CID 79775559

Frequently Asked Questions

What is the IUPAC name of 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol?
The IUPAC name of 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol (CID 79782859) is 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol.
What is the SMILES notation for 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol?
The canonical SMILES for 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol is Oc1ccc(CNc2cc(Br)ccc2Br)nc1.
What is the InChIKey of 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol?
The InChIKey is DWMGSKAVVTUZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Br2N2O/c13-8-1-4-11(14)12(5-8)16-6-9-2-3-10(17)7-15-9/h1-5,7,16-17H,6H2.
What are the key properties of 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol?
6-[(2,5-dibromoanilino)methyl]pyridin-3-ol has a molecular weight of 358.03 g/mol, XLogP of 3.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2,5-dibromoanilino)methyl]pyridin-3-ol is sourced from PubChem (CID 79782859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).