2-(2-pyrimidin-2-yloxyphenyl)acetic acid

C12H10N2O3 — CID 70166639

IUPAC2-(2-pyrimidin-2-yloxyphenyl)acetic acid
SMILESO=C(O)Cc1ccccc1Oc1ncccn1
InChIInChI=1S/C12H10N2O3/c15-11(16)8-9-4-1-2-5-10(9)17-12-13-6-3-7-14-12/h1-7H,8H2,(H,15,16)
InChIKeyVDBGAJHRUUJPRD-UHFFFAOYSA-N
MW230.22 g/mol
LogP1.90
Rot. Bonds4

About 2-(2-pyrimidin-2-yloxyphenyl)acetic acid

2-(2-pyrimidin-2-yloxyphenyl)acetic acid (PubChem CID 70166639) has the molecular formula C12H10N2O3 and a molecular weight of 230.22 g/mol. Its IUPAC name is 2-(2-pyrimidin-2-yloxyphenyl)acetic acid.

Molecular Properties

Compound Name2-(2-pyrimidin-2-yloxyphenyl)acetic acid
PubChem CID70166639
Molecular FormulaC12H10N2O3
Molecular Weight230.22 g/mol
Exact Mass230.07
IUPAC Name2-(2-pyrimidin-2-yloxyphenyl)acetic acid
SMILESO=C(O)Cc1ccccc1Oc1ncccn1
InChIInChI=1S/C12H10N2O3/c15-11(16)8-9-4-1-2-5-10(9)17-12-13-6-3-7-14-12/h1-7H,8H2,(H,15,16)
InChIKeyVDBGAJHRUUJPRD-UHFFFAOYSA-N
XLogP1.90
TPSA72.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.22
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[2-(carboxymethyl)phenoxy]phenyl]acetic acid
CID 14801619
2-[2-[(3-methyl-2-pyridinyl)oxy]phenyl]acetic acid
CID 80741818
2-(2-quinoxalin-2-yloxyphenyl)acetic acid
CID 80735910
2-[2-(2-aminophenoxy)phenyl]acetic acid
CID 13409453
2-[2-[(3-methyl-4-pyridinyl)oxy]phenyl]acetic acid
CID 80742147
2-[2-[(4-cyano-2-pyridinyl)oxy]phenyl]acetic acid
CID 80741750
2-[2-[(2-methoxy-3-pyridinyl)methoxy]phenyl]acetic acid
CID 80741526
2-[2-(5-cyanopyrazin-2-yl)oxyphenyl]acetic acid
CID 80742082
2-[2-(3-hydroxypropoxy)phenyl]acetic acid
CID 80742548
2-[2-(6-carbamoylpyridazin-3-yl)oxyphenyl]acetic acid
CID 80742351
2-[2-(6-methylsulfanylpyrimidin-4-yl)oxyphenyl]acetic acid
CID 106973530
2-[2-(4-phenoxybutoxy)phenyl]acetic acid
CID 154276164

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyrimidin-2-yloxyphenyl)acetic acid?
The IUPAC name of 2-(2-pyrimidin-2-yloxyphenyl)acetic acid (CID 70166639) is 2-(2-pyrimidin-2-yloxyphenyl)acetic acid.
What is the SMILES notation for 2-(2-pyrimidin-2-yloxyphenyl)acetic acid?
The canonical SMILES for 2-(2-pyrimidin-2-yloxyphenyl)acetic acid is O=C(O)Cc1ccccc1Oc1ncccn1.
What is the InChIKey of 2-(2-pyrimidin-2-yloxyphenyl)acetic acid?
The InChIKey is VDBGAJHRUUJPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O3/c15-11(16)8-9-4-1-2-5-10(9)17-12-13-6-3-7-14-12/h1-7H,8H2,(H,15,16).
What are the key properties of 2-(2-pyrimidin-2-yloxyphenyl)acetic acid?
2-(2-pyrimidin-2-yloxyphenyl)acetic acid has a molecular weight of 230.22 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyrimidin-2-yloxyphenyl)acetic acid is sourced from PubChem (CID 70166639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).