(5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol

C10H8BrN3O — CID 171846031

IUPAC(5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol
SMILESOC(c1ccc(Br)cn1)c1ncccn1
InChIInChI=1S/C10H8BrN3O/c11-7-2-3-8(14-6-7)9(15)10-12-4-1-5-13-10/h1-6,9,15H
InChIKeySYCUGZVYXITCCR-UHFFFAOYSA-N
MW266.10 g/mol
LogP1.72
Rot. Bonds2

About (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol

(5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol (PubChem CID 171846031) has the molecular formula C10H8BrN3O and a molecular weight of 266.10 g/mol. Its IUPAC name is (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol.

Molecular Properties

Compound Name(5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol
PubChem CID171846031
Molecular FormulaC10H8BrN3O
Molecular Weight266.10 g/mol
Exact Mass264.99
IUPAC Name(5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol
SMILESOC(c1ccc(Br)cn1)c1ncccn1
InChIInChI=1S/C10H8BrN3O/c11-7-2-3-8(14-6-7)9(15)10-12-4-1-5-13-10/h1-6,9,15H
InChIKeySYCUGZVYXITCCR-UHFFFAOYSA-N
XLogP1.72
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.10
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(5-bromo-2-pyridinyl)-phenylmethanol
CID 10587663
1-(5-bromo-2-pyridinyl)ethanol
CID 42614288
(5-bromo-2-pyridinyl)-(3-fluoro-4-pyridinyl)methanol
CID 104737732
5-bromopyridine-2-carbaldehyde;(5-bromo-2-pyridinyl)-phenylmethanol
CID 160603404
(5-bromo-2-pyridinyl)-(4-cyclobutylphenyl)methanol
CID 116505490
(5-bromo-2-pyridinyl)-(1-ethylimidazol-2-yl)methanol
CID 62960127
(5-bromo-2-pyridinyl)-(3,4-difluorophenyl)methanol
CID 115606173
(5-bromo-2-pyridinyl)-(3,4-dimethylphenyl)methanol
CID 113230461
(5-bromo-2-pyridinyl)-(2,5-dimethylphenyl)methanol
CID 115606170
[(1S)-1-(5-bromo-2-pyridinyl)ethyl]azanium chloride
CID 89251860
2-(4-bromophenyl)-1-(5-bromo-2-pyridinyl)ethanol
CID 113393940
3-bromo-1-(5-bromo-2-pyridinyl)propane-1,2-diol
CID 171861041

Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol?
The IUPAC name of (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol (CID 171846031) is (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol.
What is the SMILES notation for (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol?
The canonical SMILES for (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol is OC(c1ccc(Br)cn1)c1ncccn1.
What is the InChIKey of (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol?
The InChIKey is SYCUGZVYXITCCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3O/c11-7-2-3-8(14-6-7)9(15)10-12-4-1-5-13-10/h1-6,9,15H.
What are the key properties of (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol?
(5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol has a molecular weight of 266.10 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol is sourced from PubChem (CID 171846031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).