2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile

C14H12N2O2 — CID 15369624

IUPAC2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile
SMILESCOc1ccccc1C(C#N)c1cncc(O)c1
InChIInChI=1S/C14H12N2O2/c1-18-14-5-3-2-4-12(14)13(7-15)10-6-11(17)9-16-8-10/h2-6,8-9,13,17H,1H3
InChIKeyDFRPWZIZUZJLIZ-UHFFFAOYSA-N
MW240.26 g/mol
LogP2.45
Rot. Bonds3

About 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile

2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile (PubChem CID 15369624) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile.

Molecular Properties

Compound Name2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile
PubChem CID15369624
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Name2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile
SMILESCOc1ccccc1C(C#N)c1cncc(O)c1
InChIInChI=1S/C14H12N2O2/c1-18-14-5-3-2-4-12(14)13(7-15)10-6-11(17)9-16-8-10/h2-6,8-9,13,17H,1H3
InChIKeyDFRPWZIZUZJLIZ-UHFFFAOYSA-N
XLogP2.45
TPSA66.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenyl)-2-pyridin-2-ylacetonitrile
CID 10704351
2-(2-methoxyphenyl)-2-(5-nitro-2-pyridinyl)acetonitrile
CID 82092784
(2S)-2-(6-chloropyrimidin-4-yl)-2-(2-methoxyphenyl)acetonitrile
CID 146674037
[(2-methoxyphenyl)-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105191302
2-(4-methoxynaphthalen-1-yl)-2-phenylacetonitrile
CID 16736122
2-[4-chloro-2-[cyano-(2-methoxyphenyl)methyl]phenyl]propanoic acid
CID 68686694
2-cyano-2-(2-methoxyphenyl)acetamide
CID 16762344
3-(5-bromothiophen-3-yl)-2-(2-methoxyphenyl)-3-oxopropanenitrile
CID 107962458
3-[hydroxy-(2-methoxyphenyl)methyl]benzonitrile
CID 115481118
2-(2-methoxyphenyl)-3-pyridin-4-ylpropanenitrile
CID 82084081
[3-(2-methoxyphenyl)-3-phenylprop-1-ynyl]-trimethylsilane
CID 11011866
3-amino-2-(2-methoxyphenyl)propanenitrile
CID 82503443

Frequently Asked Questions

What is the IUPAC name of 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile?
The IUPAC name of 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile (CID 15369624) is 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile.
What is the SMILES notation for 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile?
The canonical SMILES for 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile is COc1ccccc1C(C#N)c1cncc(O)c1.
What is the InChIKey of 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile?
The InChIKey is DFRPWZIZUZJLIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c1-18-14-5-3-2-4-12(14)13(7-15)10-6-11(17)9-16-8-10/h2-6,8-9,13,17H,1H3.
What are the key properties of 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile?
2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile has a molecular weight of 240.26 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-hydroxy-3-pyridinyl)-2-(2-methoxyphenyl)acetonitrile is sourced from PubChem (CID 15369624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).