2-(2-propoxypyrimidin-4-yl)oxyethanol

C9H14N2O3 — CID 68639472

IUPAC2-(2-propoxypyrimidin-4-yl)oxyethanol
SMILESCCCOc1nccc(OCCO)n1
InChIInChI=1S/C9H14N2O3/c1-2-6-14-9-10-4-3-8(11-9)13-7-5-12/h3-4,12H,2,5-7H2,1H3
InChIKeyGQOUJCWHEZJOON-UHFFFAOYSA-N
MW198.22 g/mol
LogP0.64
Rot. Bonds6

About 2-(2-propoxypyrimidin-4-yl)oxyethanol

2-(2-propoxypyrimidin-4-yl)oxyethanol (PubChem CID 68639472) has the molecular formula C9H14N2O3 and a molecular weight of 198.22 g/mol. Its IUPAC name is 2-(2-propoxypyrimidin-4-yl)oxyethanol.

Molecular Properties

Compound Name2-(2-propoxypyrimidin-4-yl)oxyethanol
PubChem CID68639472
Molecular FormulaC9H14N2O3
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC Name2-(2-propoxypyrimidin-4-yl)oxyethanol
SMILESCCCOc1nccc(OCCO)n1
InChIInChI=1S/C9H14N2O3/c1-2-6-14-9-10-4-3-8(11-9)13-7-5-12/h3-4,12H,2,5-7H2,1H3
InChIKeyGQOUJCWHEZJOON-UHFFFAOYSA-N
XLogP0.64
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-2-propoxypyrimidine
CID 173471220
2-[2-(propylamino)pyrimidin-4-yl]oxyethanol
CID 80860272
4-propoxypyrimidin-2-amine
CID 79002172
2-(4-ethoxypyrimidin-2-yl)oxyethanamine
CID 112639005
2-(4-propoxypyrimidin-2-yl)acetic acid
CID 104571285
3-[(4-propoxypyrimidin-2-yl)amino]butan-1-ol
CID 112638477
N-methyl-1-[3-(4-propoxypyrimidin-2-yl)oxycyclobutyl]methanamine
CID 112639076
2-[6-[(2R,4R)-3-[2,6-bis(2-hydroxyethoxy)pyrimidin-4-yl]-2,4-diphenylcyclobutyl]-2-propoxypyrimidin-4-yl]oxyethanol
CID 122470162
2-ethoxy-4-methoxypyrimidine
CID 119088608
[2-(4-propoxypyrimidin-2-yl)oxycyclopentyl]methanamine
CID 112639060
(2-propoxy-4-pyridinyl)methanol
CID 61256143
N-methoxy-6-[2-[6-(methoxyamino)-6-oxohexoxy]pyrimidin-4-yl]oxyhexanamide
CID 90073888

Frequently Asked Questions

What is the IUPAC name of 2-(2-propoxypyrimidin-4-yl)oxyethanol?
The IUPAC name of 2-(2-propoxypyrimidin-4-yl)oxyethanol (CID 68639472) is 2-(2-propoxypyrimidin-4-yl)oxyethanol.
What is the SMILES notation for 2-(2-propoxypyrimidin-4-yl)oxyethanol?
The canonical SMILES for 2-(2-propoxypyrimidin-4-yl)oxyethanol is CCCOc1nccc(OCCO)n1.
What is the InChIKey of 2-(2-propoxypyrimidin-4-yl)oxyethanol?
The InChIKey is GQOUJCWHEZJOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3/c1-2-6-14-9-10-4-3-8(11-9)13-7-5-12/h3-4,12H,2,5-7H2,1H3.
What are the key properties of 2-(2-propoxypyrimidin-4-yl)oxyethanol?
2-(2-propoxypyrimidin-4-yl)oxyethanol has a molecular weight of 198.22 g/mol, XLogP of 0.64, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propoxypyrimidin-4-yl)oxyethanol is sourced from PubChem (CID 68639472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).