(2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone

C10H16FNO2 — CID 131000863

IUPAC(2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone
SMILESCC1CC(O)CN1C(=O)C1(C)CC1F
InChIInChI=1S/C10H16FNO2/c1-6-3-7(13)5-12(6)9(14)10(2)4-8(10)11/h6-8,13H,3-5H2,1-2H3
InChIKeyZJSKPLWXVBOSNB-UHFFFAOYSA-N
MW201.24 g/mol
LogP0.72
Rot. Bonds1

About (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone

(2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone (PubChem CID 131000863) has the molecular formula C10H16FNO2 and a molecular weight of 201.24 g/mol. Its IUPAC name is (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone
PubChem CID131000863
Molecular FormulaC10H16FNO2
Molecular Weight201.24 g/mol
Exact Mass201.12
IUPAC Name(2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone
SMILESCC1CC(O)CN1C(=O)C1(C)CC1F
InChIInChI=1S/C10H16FNO2/c1-6-3-7(13)5-12(6)9(14)10(2)4-8(10)11/h6-8,13H,3-5H2,1-2H3
InChIKeyZJSKPLWXVBOSNB-UHFFFAOYSA-N
XLogP0.72
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.24
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone?
The IUPAC name of (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone (CID 131000863) is (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone?
The canonical SMILES for (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone is CC1CC(O)CN1C(=O)C1(C)CC1F.
What is the InChIKey of (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone?
The InChIKey is ZJSKPLWXVBOSNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FNO2/c1-6-3-7(13)5-12(6)9(14)10(2)4-8(10)11/h6-8,13H,3-5H2,1-2H3.
What are the key properties of (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone?
(2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone has a molecular weight of 201.24 g/mol, XLogP of 0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-1-methylcyclopropyl)-(4-hydroxy-2-methylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 131000863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).