2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol

C7H14N2O — CID 20512840

IUPAC2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol
SMILESCC1NCC=CN1CCO
InChIInChI=1S/C7H14N2O/c1-7-8-3-2-4-9(7)5-6-10/h2,4,7-8,10H,3,5-6H2,1H3
InChIKeyFWPCFIBPSOMZAA-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.26
Rot. Bonds2

About 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol

2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol (PubChem CID 20512840) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol.

Molecular Properties

Compound Name2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol
PubChem CID20512840
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol
SMILESCC1NCC=CN1CCO
InChIInChI=1S/C7H14N2O/c1-7-8-3-2-4-9(7)5-6-10/h2,4,7-8,10H,3,5-6H2,1H3
InChIKeyFWPCFIBPSOMZAA-UHFFFAOYSA-N
XLogP-0.26
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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2-[[(E)-3-(dimethylamino)prop-2-enyl]amino]ethanol
CID 88690436
Methanol;1,2,3,4-tetrahydropyrimidine
CID 89414303
2-[[(Z)-3-amino-1-(methylamino)prop-2-enyl]-ethylamino]ethanol
CID 90451886
3-Methyl-2-methylidene-1,6-dihydropyrimidin-6-ol
CID 117892310
3-(2-Hydroxyethyl)-1,6-dihydropyrimidin-2-one
CID 118952499
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CID 122635109

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol?
The IUPAC name of 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol (CID 20512840) is 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol.
What is the SMILES notation for 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol?
The canonical SMILES for 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol is CC1NCC=CN1CCO.
What is the InChIKey of 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol?
The InChIKey is FWPCFIBPSOMZAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-7-8-3-2-4-9(7)5-6-10/h2,4,7-8,10H,3,5-6H2,1H3.
What are the key properties of 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol?
2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol has a molecular weight of 142.20 g/mol, XLogP of -0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-2,6-dihydro-1H-pyrimidin-3-yl)ethanol is sourced from PubChem (CID 20512840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).