3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol

C15H15NO2 — CID 65412130

IUPAC3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol
SMILESOC(c1cccnc1)C1COc2ccccc2C1
InChIInChI=1S/C15H15NO2/c17-15(12-5-3-7-16-9-12)13-8-11-4-1-2-6-14(11)18-10-13/h1-7,9,13,15,17H,8,10H2
InChIKeyRVIORJYYZFWHKR-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.37
Rot. Bonds2

About 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol

3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol (PubChem CID 65412130) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol.

Molecular Properties

Compound Name3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol
PubChem CID65412130
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol
SMILESOC(c1cccnc1)C1COc2ccccc2C1
InChIInChI=1S/C15H15NO2/c17-15(12-5-3-7-16-9-12)13-8-11-4-1-2-6-14(11)18-10-13/h1-7,9,13,15,17H,8,10H2
InChIKeyRVIORJYYZFWHKR-UHFFFAOYSA-N
XLogP2.37
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-chromen-3-yl-(3,4-dimethylphenyl)methanol
CID 65412330
5-[3,4-dihydro-2H-chromen-3-yl(hydroxy)methyl]furan-2-carboxylic acid
CID 106947406
3,4-dihydro-2H-chromen-3-yl-(2,3,4-trifluorophenyl)methanol
CID 65411549
cyclohex-3-en-1-yl(pyridin-3-yl)methanol
CID 63899340
1-(3,4-dihydro-2H-chromen-3-yl)-2-methylbutan-1-ol
CID 79446324
2,3-dihydro-1H-indol-2-yl(pyridin-3-yl)methanol
CID 65042396
3-(3,4-dihydro-2H-chromen-3-ylmethyl)pyridine
CID 72893239
2,3-dihydro-1-benzofuran-7-yl(3,4-dihydro-2H-chromen-3-yl)methanol
CID 114744588
N-(3,4-dihydro-2H-chromen-3-yl)pyridine-3-carboxamide
CID 110751511
(3-chlorophenyl)-(3,4-dihydro-2H-chromen-3-yl)methanamine
CID 65411666
[(3R)-3,4-dihydro-2H-chromen-3-yl]-(4-pyridin-3-ylpiperazin-1-yl)methanone
CID 97137307
3,4-dihydro-2H-chromen-3-yl-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106881075

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol?
The IUPAC name of 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol (CID 65412130) is 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol.
What is the SMILES notation for 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol?
The canonical SMILES for 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol is OC(c1cccnc1)C1COc2ccccc2C1.
What is the InChIKey of 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol?
The InChIKey is RVIORJYYZFWHKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c17-15(12-5-3-7-16-9-12)13-8-11-4-1-2-6-14(11)18-10-13/h1-7,9,13,15,17H,8,10H2.
What are the key properties of 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol?
3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol has a molecular weight of 241.29 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-chromen-3-yl(pyridin-3-yl)methanol is sourced from PubChem (CID 65412130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).