2-hydroxybenzoic acid;pyrimidine

C11H10N2O3 — CID 22340986

IUPAC2-hydroxybenzoic acid;pyrimidine
SMILESO=C(O)c1ccccc1O.c1cncnc1
InChIInChI=1S/C7H6O3.C4H4N2/c8-6-4-2-1-3-5(6)7(9)10;1-2-5-4-6-3-1/h1-4,8H,(H,9,10);1-4H
InChIKeyQTJCKLQRJJTCIS-UHFFFAOYSA-N
MW218.21 g/mol
LogP1.57
Rot. Bonds1

About 2-hydroxybenzoic acid;pyrimidine

2-hydroxybenzoic acid;pyrimidine (PubChem CID 22340986) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is 2-hydroxybenzoic acid;pyrimidine.

Molecular Properties

Compound Name2-hydroxybenzoic acid;pyrimidine
PubChem CID22340986
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Name2-hydroxybenzoic acid;pyrimidine
SMILESO=C(O)c1ccccc1O.c1cncnc1
InChIInChI=1S/C7H6O3.C4H4N2/c8-6-4-2-1-3-5(6)7(9)10;1-2-5-4-6-3-1/h1-4,8H,(H,9,10);1-4H
InChIKeyQTJCKLQRJJTCIS-UHFFFAOYSA-N
XLogP1.57
TPSA83.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxybenzoic acid;pyrimidine?
The IUPAC name of 2-hydroxybenzoic acid;pyrimidine (CID 22340986) is 2-hydroxybenzoic acid;pyrimidine.
What is the SMILES notation for 2-hydroxybenzoic acid;pyrimidine?
The canonical SMILES for 2-hydroxybenzoic acid;pyrimidine is O=C(O)c1ccccc1O.c1cncnc1.
What is the InChIKey of 2-hydroxybenzoic acid;pyrimidine?
The InChIKey is QTJCKLQRJJTCIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O3.C4H4N2/c8-6-4-2-1-3-5(6)7(9)10;1-2-5-4-6-3-1/h1-4,8H,(H,9,10);1-4H.
What are the key properties of 2-hydroxybenzoic acid;pyrimidine?
2-hydroxybenzoic acid;pyrimidine has a molecular weight of 218.21 g/mol, XLogP of 1.57, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxybenzoic acid;pyrimidine is sourced from PubChem (CID 22340986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).