[2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol

C11H16FN3O — CID 103703711

IUPAC[2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol
SMILESCc1ncnc(NC2CCCC2CO)c1F
InChIInChI=1S/C11H16FN3O/c1-7-10(12)11(14-6-13-7)15-9-4-2-3-8(9)5-16/h6,8-9,16H,2-5H2,1H3,(H,13,14,15)
InChIKeyZWCZPSMDMCRVET-UHFFFAOYSA-N
MW225.27 g/mol
LogP1.50
Rot. Bonds3

About [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol

[2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol (PubChem CID 103703711) has the molecular formula C11H16FN3O and a molecular weight of 225.27 g/mol. Its IUPAC name is [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol
PubChem CID103703711
Molecular FormulaC11H16FN3O
Molecular Weight225.27 g/mol
Exact Mass225.13
IUPAC Name[2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol
SMILESCc1ncnc(NC2CCCC2CO)c1F
InChIInChI=1S/C11H16FN3O/c1-7-10(12)11(14-6-13-7)15-9-4-2-3-8(9)5-16/h6,8-9,16H,2-5H2,1H3,(H,13,14,15)
InChIKeyZWCZPSMDMCRVET-UHFFFAOYSA-N
XLogP1.50
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol?
The IUPAC name of [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol (CID 103703711) is [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol?
The canonical SMILES for [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol is Cc1ncnc(NC2CCCC2CO)c1F.
What is the InChIKey of [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol?
The InChIKey is ZWCZPSMDMCRVET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3O/c1-7-10(12)11(14-6-13-7)15-9-4-2-3-8(9)5-16/h6,8-9,16H,2-5H2,1H3,(H,13,14,15).
What are the key properties of [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol?
[2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol has a molecular weight of 225.27 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]cyclopentyl]methanol is sourced from PubChem (CID 103703711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).