4-(1,2-dimethoxyethyl)-2-phenylpyridine

C15H17NO2 — CID 135042971

IUPAC4-(1,2-dimethoxyethyl)-2-phenylpyridine
SMILESCOCC(OC)c1ccnc(-c2ccccc2)c1
InChIInChI=1S/C15H17NO2/c1-17-11-15(18-2)13-8-9-16-14(10-13)12-6-4-3-5-7-12/h3-10,15H,11H2,1-2H3
InChIKeyGKAGPQJSPZTZQF-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.08
Rot. Bonds5

About 4-(1,2-dimethoxyethyl)-2-phenylpyridine

4-(1,2-dimethoxyethyl)-2-phenylpyridine (PubChem CID 135042971) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 4-(1,2-dimethoxyethyl)-2-phenylpyridine.

Molecular Properties

Compound Name4-(1,2-dimethoxyethyl)-2-phenylpyridine
PubChem CID135042971
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name4-(1,2-dimethoxyethyl)-2-phenylpyridine
SMILESCOCC(OC)c1ccnc(-c2ccccc2)c1
InChIInChI=1S/C15H17NO2/c1-17-11-15(18-2)13-8-9-16-14(10-13)12-6-4-3-5-7-12/h3-10,15H,11H2,1-2H3
InChIKeyGKAGPQJSPZTZQF-UHFFFAOYSA-N
XLogP3.08
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

benzene;[(1R)-1,2-dimethoxyethyl]benzene
CID 178156280
2-(2-phenyl-4-pyridinyl)butanal
CID 173202793
6-(1,2-dimethoxyethyl)quinoline-4-carboxamide
CID 175960443
5-[3-(1,2-dimethoxyethyl)phenyl]-1,2-oxazole-3-carboxylic acid
CID 117443882
silver bis(4-methyl-2-phenylpyridine)
CID 140722040
4-(1,2-dimethoxyethyl)-1,2-dimethoxybenzene
CID 6424872
2-phenyl-2-(2-phenyl-4-pyridinyl)acetamide
CID 69129483
2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine
CID 140599873
4-ethyl-2-phenylpyridine;fluoroform;iridium
CID 174671800
4-[4-(2-deuteriopropan-2-yl)phenyl]-2-phenylpyridine
CID 140831627
dimethyl-phenyl-(2-phenyl-4-pyridinyl)germane
CID 140726208
dimethyl-phenyl-(2-phenyl-4-pyridinyl)silane
CID 140629348

Frequently Asked Questions

What is the IUPAC name of 4-(1,2-dimethoxyethyl)-2-phenylpyridine?
The IUPAC name of 4-(1,2-dimethoxyethyl)-2-phenylpyridine (CID 135042971) is 4-(1,2-dimethoxyethyl)-2-phenylpyridine.
What is the SMILES notation for 4-(1,2-dimethoxyethyl)-2-phenylpyridine?
The canonical SMILES for 4-(1,2-dimethoxyethyl)-2-phenylpyridine is COCC(OC)c1ccnc(-c2ccccc2)c1.
What is the InChIKey of 4-(1,2-dimethoxyethyl)-2-phenylpyridine?
The InChIKey is GKAGPQJSPZTZQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-17-11-15(18-2)13-8-9-16-14(10-13)12-6-4-3-5-7-12/h3-10,15H,11H2,1-2H3.
What are the key properties of 4-(1,2-dimethoxyethyl)-2-phenylpyridine?
4-(1,2-dimethoxyethyl)-2-phenylpyridine has a molecular weight of 243.31 g/mol, XLogP of 3.08, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2-dimethoxyethyl)-2-phenylpyridine is sourced from PubChem (CID 135042971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).