[2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol

C11H16N2O2 — CID 67281799

IUPAC[2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol
SMILESCc1ncc(OCC2CC2CO)c(C)n1
InChIInChI=1S/C11H16N2O2/c1-7-11(4-12-8(2)13-7)15-6-10-3-9(10)5-14/h4,9-10,14H,3,5-6H2,1-2H3
InChIKeyQETKAYHEWQPZJF-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.10
Rot. Bonds4

About [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol

[2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol (PubChem CID 67281799) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol
PubChem CID67281799
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name[2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol
SMILESCc1ncc(OCC2CC2CO)c(C)n1
InChIInChI=1S/C11H16N2O2/c1-7-11(4-12-8(2)13-7)15-6-10-3-9(10)5-14/h4,9-10,14H,3,5-6H2,1-2H3
InChIKeyQETKAYHEWQPZJF-UHFFFAOYSA-N
XLogP1.10
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol?
The IUPAC name of [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol (CID 67281799) is [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol.
What is the SMILES notation for [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol?
The canonical SMILES for [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol is Cc1ncc(OCC2CC2CO)c(C)n1.
What is the InChIKey of [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol?
The InChIKey is QETKAYHEWQPZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7-11(4-12-8(2)13-7)15-6-10-3-9(10)5-14/h4,9-10,14H,3,5-6H2,1-2H3.
What are the key properties of [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol?
[2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol has a molecular weight of 208.26 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]cyclopropyl]methanol is sourced from PubChem (CID 67281799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).