2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol

C11H16FN3O — CID 102675218

IUPAC2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol
SMILESCc1ncnc(N(CCO)C2CCC2)c1F
InChIInChI=1S/C11H16FN3O/c1-8-10(12)11(14-7-13-8)15(5-6-16)9-3-2-4-9/h7,9,16H,2-6H2,1H3
InChIKeyRILBUJMYEZFAIX-UHFFFAOYSA-N
MW225.27 g/mol
LogP1.28
Rot. Bonds4

About 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol

2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol (PubChem CID 102675218) has the molecular formula C11H16FN3O and a molecular weight of 225.27 g/mol. Its IUPAC name is 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol
PubChem CID102675218
Molecular FormulaC11H16FN3O
Molecular Weight225.27 g/mol
Exact Mass225.13
IUPAC Name2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol
SMILESCc1ncnc(N(CCO)C2CCC2)c1F
InChIInChI=1S/C11H16FN3O/c1-8-10(12)11(14-7-13-8)15(5-6-16)9-3-2-4-9/h7,9,16H,2-6H2,1H3
InChIKeyRILBUJMYEZFAIX-UHFFFAOYSA-N
XLogP1.28
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-fluoro-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine
CID 118549378
4-(5-Fluoro-6-methylpyrimidin-4-yl)morpholine
CID 126972140
(5-Fluoro-4-methylpyrimidin-2-yl)methanol
CID 143732565
2-[4-(6-Ethyl-5-fluoropyrimidin-4-yl)piperazin-1-yl]propan-1-ol
CID 75437962
(2S)-2-[4-(6-ethyl-5-fluoropyrimidin-4-yl)piperazin-1-yl]propan-1-ol
CID 97331717
(2R)-2-[4-(6-ethyl-5-fluoropyrimidin-4-yl)piperazin-1-yl]propan-1-ol
CID 97331718
2-[(6-Ethyl-5-fluoropyrimidin-4-yl)-propan-2-ylamino]ethanol
CID 100672941
N-(3-ethoxycyclobutyl)-5-fluoro-6-methylpyrimidin-4-amine
CID 102609291
3-[[(5-Fluoro-6-methylpyrimidin-4-yl)-methylamino]methyl]cyclobutan-1-ol
CID 102809546
[1-(5-Fluoro-6-methylpyrimidin-4-yl)-3-methylpyrrolidin-2-yl]methanol
CID 102809627
5-fluoro-N-(2-methoxypropyl)-6-methylpyrimidin-4-amine
CID 102809645
3-[Cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]propan-1-ol
CID 102846781

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol (CID 102675218) is 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol is Cc1ncnc(N(CCO)C2CCC2)c1F.
What is the InChIKey of 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol?
The InChIKey is RILBUJMYEZFAIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3O/c1-8-10(12)11(14-7-13-8)15(5-6-16)9-3-2-4-9/h7,9,16H,2-6H2,1H3.
What are the key properties of 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol?
2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol has a molecular weight of 225.27 g/mol, XLogP of 1.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl-(5-fluoro-6-methylpyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 102675218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).