2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol

C11H16N2O — CID 130601446

IUPAC2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol
SMILESCC1(CC(O)c2ncccn2)CCC1
InChIInChI=1S/C11H16N2O/c1-11(4-2-5-11)8-9(14)10-12-6-3-7-13-10/h3,6-7,9,14H,2,4-5,8H2,1H3
InChIKeyROVQFOWZCODMKA-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.09
Rot. Bonds3

About 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol

2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol (PubChem CID 130601446) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol.

Molecular Properties

Compound Name2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol
PubChem CID130601446
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol
SMILESCC1(CC(O)c2ncccn2)CCC1
InChIInChI=1S/C11H16N2O/c1-11(4-2-5-11)8-9(14)10-12-6-3-7-13-10/h3,6-7,9,14H,2,4-5,8H2,1H3
InChIKeyROVQFOWZCODMKA-UHFFFAOYSA-N
XLogP2.09
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-pyrimidin-2-ylbutan-1-ol
CID 60798581
1-(5-bromothiophen-2-yl)-2-(1-methylcyclobutyl)ethanol
CID 130601456
N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine
CID 103736890
2-cyclopentyl-1-pyrimidin-2-ylethanol
CID 62608023
2-(1-methylcyclopropyl)-1-(4-methyl-3-pyridinyl)ethanol
CID 130961576
2-(1-methylcyclohexyl)ethane-1,1-diol
CID 59872782
2-(1-methylcyclobutyl)-1-(1-methylcyclopentyl)ethanamine
CID 130602100
N-[(1-methylcyclopentyl)methyl]pyrimidin-2-amine
CID 63822155
2-(4-fluorophenyl)-1-pyrimidin-2-ylethanol
CID 60798851
2-(5-chlorothiophen-2-yl)-1-pyrimidin-2-ylethanol
CID 62607085
2-(2,6-dichlorophenyl)-1-pyrimidin-2-ylethanol
CID 62606143
3-methylsulfonyl-1-pyrimidin-2-ylpropan-1-ol
CID 62608221

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol?
The IUPAC name of 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol (CID 130601446) is 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol.
What is the SMILES notation for 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol?
The canonical SMILES for 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol is CC1(CC(O)c2ncccn2)CCC1.
What is the InChIKey of 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol?
The InChIKey is ROVQFOWZCODMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-11(4-2-5-11)8-9(14)10-12-6-3-7-13-10/h3,6-7,9,14H,2,4-5,8H2,1H3.
What are the key properties of 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol?
2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol has a molecular weight of 192.26 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylcyclobutyl)-1-pyrimidin-2-ylethanol is sourced from PubChem (CID 130601446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).