6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid

C10H8N2O3 — CID 121206884

IUPAC6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid
SMILESCc1nc(C(=O)O)cc(-c2ccco2)n1
InChIInChI=1S/C10H8N2O3/c1-6-11-7(9-3-2-4-15-9)5-8(12-6)10(13)14/h2-5H,1H3,(H,13,14)
InChIKeySWIPSFSBJSPBMK-UHFFFAOYSA-N
MW204.19 g/mol
LogP1.74
Rot. Bonds2

About 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid

6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid (PubChem CID 121206884) has the molecular formula C10H8N2O3 and a molecular weight of 204.19 g/mol. Its IUPAC name is 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid.

Molecular Properties

Compound Name6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid
PubChem CID121206884
Molecular FormulaC10H8N2O3
Molecular Weight204.19 g/mol
Exact Mass204.05
IUPAC Name6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid
SMILESCc1nc(C(=O)O)cc(-c2ccco2)n1
InChIInChI=1S/C10H8N2O3/c1-6-11-7(9-3-2-4-15-9)5-8(12-6)10(13)14/h2-5H,1H3,(H,13,14)
InChIKeySWIPSFSBJSPBMK-UHFFFAOYSA-N
XLogP1.74
TPSA76.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(furan-2-yl)pyridine-2,6-dicarboxylic acid
CID 138673812
6-(furan-2-yl)pyridine-2-carboxylic acid
CID 24730128
4-(furan-2-yl)pyrimidine-2-carboxylic acid
CID 82404248
5-(furan-2-yl)-1-methylpyrazole-3-carboxylic acid
CID 7537639
[2-amino-6-(furan-2-yl)pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 11173320
8-chloro-2-(furan-2-yl)quinoline-4-carboxylic acid
CID 3853520
2-amino-N-benzyl-6-(furan-2-yl)-N-methylpyrimidine-4-carboxamide
CID 59022943
5-chloro-2-(furan-2-yl)quinoline-4-carboxylic acid
CID 14006738
6-(4-methoxy-2,3-dimethylphenyl)-2-methylpyrimidine-4-carboxylic acid
CID 82306334
5-(furan-2-yl)-4-methyl-1,3-thiazole-2-carboxylic acid
CID 82126671
2-amino-6-(furan-2-yl)-N-(3-methyl-2-pyridinyl)pyrimidine-4-carboxamide
CID 11197188
2-[4-(furan-2-yl)phenyl]-6-methylquinoline-4-carboxylic acid
CID 168527201

Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid?
The IUPAC name of 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid (CID 121206884) is 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid.
What is the SMILES notation for 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid?
The canonical SMILES for 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid is Cc1nc(C(=O)O)cc(-c2ccco2)n1.
What is the InChIKey of 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid?
The InChIKey is SWIPSFSBJSPBMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O3/c1-6-11-7(9-3-2-4-15-9)5-8(12-6)10(13)14/h2-5H,1H3,(H,13,14).
What are the key properties of 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid?
6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid has a molecular weight of 204.19 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-2-methylpyrimidine-4-carboxylic acid is sourced from PubChem (CID 121206884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).