(2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol

C10H12FNO — CID 163954247

IUPAC(2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol
SMILESC=C1N[C@H](C)/C(=C\C=C\F)C=C1O
InChIInChI=1S/C10H12FNO/c1-7-9(4-3-5-11)6-10(13)8(2)12-7/h3-7,12-13H,2H2,1H3/b5-3+,9-4-/t7-/m1/s1
InChIKeySBYMBKSNXNDFTO-AJKXYMPOSA-N
MW181.21 g/mol
LogP2.34
Rot. Bonds1

About (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol

(2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol (PubChem CID 163954247) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol.

Molecular Properties

Compound Name(2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol
PubChem CID163954247
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name(2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol
SMILESC=C1N[C@H](C)/C(=C\C=C\F)C=C1O
InChIInChI=1S/C10H12FNO/c1-7-9(4-3-5-11)6-10(13)8(2)12-7/h3-7,12-13H,2H2,1H3/b5-3+,9-4-/t7-/m1/s1
InChIKeySBYMBKSNXNDFTO-AJKXYMPOSA-N
XLogP2.34
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol with MolForge

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Related Compounds

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1-(Cyclohexa-1,5-dien-1-ylamino)-2-methylpropan-2-ol
CID 175763250
(2E,4E,6Z)-4-[[(2E,4Z)-2-ethenyl-3-methylhexa-2,4-dienyl]amino]octa-2,4,6-trien-3-ol
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1-(3,6-Dimethyl-1,2-dihydropyridin-2-yl)ethenol
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Frequently Asked Questions

What is the IUPAC name of (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol?
The IUPAC name of (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol (CID 163954247) is (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol.
What is the SMILES notation for (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol?
The canonical SMILES for (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol is C=C1N[C@H](C)/C(=C\C=C\F)C=C1O.
What is the InChIKey of (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol?
The InChIKey is SBYMBKSNXNDFTO-AJKXYMPOSA-N. The full InChI is InChI=1S/C10H12FNO/c1-7-9(4-3-5-11)6-10(13)8(2)12-7/h3-7,12-13H,2H2,1H3/b5-3+,9-4-/t7-/m1/s1.
What are the key properties of (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol?
(2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol has a molecular weight of 181.21 g/mol, XLogP of 2.34, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3Z)-3-[(E)-3-fluoroprop-2-enylidene]-2-methyl-6-methylidene-1,2-dihydropyridin-5-ol is sourced from PubChem (CID 163954247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).