1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one

C10H12FNO2 — CID 175934964

IUPAC1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one
SMILESCc1cc(O)cc(=O)n1C1(CF)CC1
InChIInChI=1S/C10H12FNO2/c1-7-4-8(13)5-9(14)12(7)10(6-11)2-3-10/h4-5,13H,2-3,6H2,1H3
InChIKeyOTRDYBBOQMLZMC-UHFFFAOYSA-N
MW197.21 g/mol
LogP1.32
Rot. Bonds2

About 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one

1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one (PubChem CID 175934964) has the molecular formula C10H12FNO2 and a molecular weight of 197.21 g/mol. Its IUPAC name is 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one.

Molecular Properties

Compound Name1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one
PubChem CID175934964
Molecular FormulaC10H12FNO2
Molecular Weight197.21 g/mol
Exact Mass197.09
IUPAC Name1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one
SMILESCc1cc(O)cc(=O)n1C1(CF)CC1
InChIInChI=1S/C10H12FNO2/c1-7-4-8(13)5-9(14)12(7)10(6-11)2-3-10/h4-5,13H,2-3,6H2,1H3
InChIKeyOTRDYBBOQMLZMC-UHFFFAOYSA-N
XLogP1.32
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Cyclopropyl-4-hydroxy-6-methyl-1,2-dihydropyridin-2-one
CID 54704852
1-Cyclopropylmethyl-4-hydroxy-6-methyl-1H-pyridin-2-one
CID 54703058
1-Tert-butyl-4-hydroxy-6-methylpyridin-2-one
CID 58821072
1-But-1-en-2-yl-4-hydroxy-6-methylpyridin-2-one
CID 155599940

Frequently Asked Questions

What is the IUPAC name of 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one?
The IUPAC name of 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one (CID 175934964) is 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one.
What is the SMILES notation for 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one?
The canonical SMILES for 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one is Cc1cc(O)cc(=O)n1C1(CF)CC1.
What is the InChIKey of 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one?
The InChIKey is OTRDYBBOQMLZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2/c1-7-4-8(13)5-9(14)12(7)10(6-11)2-3-10/h4-5,13H,2-3,6H2,1H3.
What are the key properties of 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one?
1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one has a molecular weight of 197.21 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one is sourced from PubChem (CID 175934964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).