2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol

C12H14N2O2 — CID 116902086

IUPAC2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol
SMILESCc1ccc(-c2ccnc(C(C)(C)O)n2)o1
InChIInChI=1S/C12H14N2O2/c1-8-4-5-10(16-8)9-6-7-13-11(14-9)12(2,3)15/h4-7,15H,1-3H3
InChIKeyCUSPJIGSNVSBEH-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.27
Rot. Bonds2

About 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol

2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol (PubChem CID 116902086) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol.

Molecular Properties

Compound Name2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol
PubChem CID116902086
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol
SMILESCc1ccc(-c2ccnc(C(C)(C)O)n2)o1
InChIInChI=1S/C12H14N2O2/c1-8-4-5-10(16-8)9-6-7-13-11(14-9)12(2,3)15/h4-7,15H,1-3H3
InChIKeyCUSPJIGSNVSBEH-UHFFFAOYSA-N
XLogP2.27
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-methyl-2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propanoate
CID 116901354
[4-(5-methylfuran-2-yl)pyrimidin-2-yl]methanol
CID 116899503
2-methoxy-4-(5-methylfuran-2-yl)pyrimidine
CID 116903833
2-[4-(2,4,6-trimethylphenyl)pyrimidin-2-yl]propan-2-ol
CID 116902051
2-amino-2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]ethanol
CID 116902206
2-[4-(2,4-dimethylphenyl)pyrimidin-2-yl]propan-2-ol
CID 116902043
2-amino-2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]acetic acid
CID 116902136
3-methyl-2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]butanoic acid
CID 116903041
3-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]cyclobutan-1-amine
CID 116899196
2-(4-chloropyrimidin-2-yl)propan-2-ol
CID 170730611
2-methyl-3-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-1-amine
CID 116898293
2-[5-(5-methylfuran-2-yl)-1H-imidazol-2-yl]propan-2-ol
CID 116881432

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol?
The IUPAC name of 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol (CID 116902086) is 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol.
What is the SMILES notation for 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol?
The canonical SMILES for 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol is Cc1ccc(-c2ccnc(C(C)(C)O)n2)o1.
What is the InChIKey of 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol?
The InChIKey is CUSPJIGSNVSBEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-8-4-5-10(16-8)9-6-7-13-11(14-9)12(2,3)15/h4-7,15H,1-3H3.
What are the key properties of 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol?
2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol has a molecular weight of 218.26 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-ol is sourced from PubChem (CID 116902086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).