6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile

C15H14N2O2 — CID 43244931

IUPAC6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile
SMILESCOCCc1ccc(Oc2ccc(C#N)cn2)cc1
InChIInChI=1S/C15H14N2O2/c1-18-9-8-12-2-5-14(6-3-12)19-15-7-4-13(10-16)11-17-15/h2-7,11H,8-9H2,1H3
InChIKeyPCTLSQWYKHJAPZ-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.93
Rot. Bonds5

About 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile

6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile (PubChem CID 43244931) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile
PubChem CID43244931
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile
SMILESCOCCc1ccc(Oc2ccc(C#N)cn2)cc1
InChIInChI=1S/C15H14N2O2/c1-18-9-8-12-2-5-14(6-3-12)19-15-7-4-13(10-16)11-17-15/h2-7,11H,8-9H2,1H3
InChIKeyPCTLSQWYKHJAPZ-UHFFFAOYSA-N
XLogP2.93
TPSA55.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-2-[4-(2-methoxyethyl)phenoxy]pyridine
CID 61373244
6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbaldehyde
CID 80631991
2-chloro-6-[4-(2-methoxyethyl)phenoxy]pyridine-4-carbonitrile
CID 83074306
4-[[4-[4-(2-methoxyethyl)phenoxy]pyrimidin-2-yl]amino]benzonitrile
CID 71740451
6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carboximidamide
CID 43352096
2-[4-(2-methoxyethyl)phenoxy]acetonitrile
CID 43237929
4-[[4-[4-(2-methoxyethyl)phenoxy]-5-methylpyrimidin-2-yl]amino]benzonitrile
CID 71740683
2-[4-(2-methoxyethyl)phenoxy]-5-methylpyridin-4-amine
CID 83267065
4-fluoro-6-[4-(2-methoxyethyl)phenoxy]pyrimidine
CID 113305637
6-[2-(3-methoxypropoxy)ethoxy]pyridine-3-carbonitrile
CID 103177589
6-[5-(4-cyanophenoxy)pentoxy]pyridine-3-carbonitrile
CID 150538263
6-[4-[(2-thiophen-2-ylethylamino)methyl]phenoxy]pyridine-3-carbonitrile
CID 58878931

Frequently Asked Questions

What is the IUPAC name of 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile?
The IUPAC name of 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile (CID 43244931) is 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile?
The canonical SMILES for 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile is COCCc1ccc(Oc2ccc(C#N)cn2)cc1.
What is the InChIKey of 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile?
The InChIKey is PCTLSQWYKHJAPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-18-9-8-12-2-5-14(6-3-12)19-15-7-4-13(10-16)11-17-15/h2-7,11H,8-9H2,1H3.
What are the key properties of 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile?
6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile has a molecular weight of 254.29 g/mol, XLogP of 2.93, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carbonitrile is sourced from PubChem (CID 43244931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).