6-benzyl-2,3-dihydropyridin-3-ol

C12H13NO — CID 150749488

IUPAC6-benzyl-2,3-dihydropyridin-3-ol
SMILESOC1C=CC(Cc2ccccc2)=NC1
InChIInChI=1S/C12H13NO/c14-12-7-6-11(13-9-12)8-10-4-2-1-3-5-10/h1-7,12,14H,8-9H2
InChIKeyJVOCDYVJASXEED-UHFFFAOYSA-N
MW187.24 g/mol
LogP1.60
Rot. Bonds2

About 6-benzyl-2,3-dihydropyridin-3-ol

6-benzyl-2,3-dihydropyridin-3-ol (PubChem CID 150749488) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 6-benzyl-2,3-dihydropyridin-3-ol.

Molecular Properties

Compound Name6-benzyl-2,3-dihydropyridin-3-ol
PubChem CID150749488
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name6-benzyl-2,3-dihydropyridin-3-ol
SMILESOC1C=CC(Cc2ccccc2)=NC1
InChIInChI=1S/C12H13NO/c14-12-7-6-11(13-9-12)8-10-4-2-1-3-5-10/h1-7,12,14H,8-9H2
InChIKeyJVOCDYVJASXEED-UHFFFAOYSA-N
XLogP1.60
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-benzyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydropyridine
CID 123570440
6-benzyl-2,3-dihydropyridine
CID 69174847
6-benzyl-3-ethyl-2,3-dihydropyridine-4-carboxamide
CID 123626341
phenyl(113C)methylbenzene
CID 11194569
6-benzyl-3-tert-butyl-3H-pyridin-2-one
CID 58949526
2-benzylcycloprop-2-en-1-ol
CID 18539682
2-benzyl-4,5-dihydro-1,3-oxazole-5-carboxylic acid
CID 115060838
6-benzyl-2,5-dihydropyridine-5-carboxylic acid
CID 91372221
(2S)-2-benzyl-2H-azirine
CID 155642978
(1R,5R)-8-benzyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol
CID 98140534
potassium;benzylbenzene;hydride
CID 173011788
benzyl-(1H-inden-1-yl)-dimethylsilane
CID 158012531

Frequently Asked Questions

What is the IUPAC name of 6-benzyl-2,3-dihydropyridin-3-ol?
The IUPAC name of 6-benzyl-2,3-dihydropyridin-3-ol (CID 150749488) is 6-benzyl-2,3-dihydropyridin-3-ol.
What is the SMILES notation for 6-benzyl-2,3-dihydropyridin-3-ol?
The canonical SMILES for 6-benzyl-2,3-dihydropyridin-3-ol is OC1C=CC(Cc2ccccc2)=NC1.
What is the InChIKey of 6-benzyl-2,3-dihydropyridin-3-ol?
The InChIKey is JVOCDYVJASXEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c14-12-7-6-11(13-9-12)8-10-4-2-1-3-5-10/h1-7,12,14H,8-9H2.
What are the key properties of 6-benzyl-2,3-dihydropyridin-3-ol?
6-benzyl-2,3-dihydropyridin-3-ol has a molecular weight of 187.24 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-benzyl-2,3-dihydropyridin-3-ol is sourced from PubChem (CID 150749488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).