2-(2,3,4-trimethoxy-5-propylphenyl)pyridine

C17H21NO3 — CID 173295109

IUPAC2-(2,3,4-trimethoxy-5-propylphenyl)pyridine
SMILESCCCc1cc(-c2ccccn2)c(OC)c(OC)c1OC
InChIInChI=1S/C17H21NO3/c1-5-8-12-11-13(14-9-6-7-10-18-14)16(20-3)17(21-4)15(12)19-2/h6-7,9-11H,5,8H2,1-4H3
InChIKeyLNGRAOTYMNIKDY-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.73
Rot. Bonds6

About 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine

2-(2,3,4-trimethoxy-5-propylphenyl)pyridine (PubChem CID 173295109) has the molecular formula C17H21NO3 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine.

Molecular Properties

Compound Name2-(2,3,4-trimethoxy-5-propylphenyl)pyridine
PubChem CID173295109
Molecular FormulaC17H21NO3
Molecular Weight287.36 g/mol
Exact Mass287.15
IUPAC Name2-(2,3,4-trimethoxy-5-propylphenyl)pyridine
SMILESCCCc1cc(-c2ccccn2)c(OC)c(OC)c1OC
InChIInChI=1S/C17H21NO3/c1-5-8-12-11-13(14-9-6-7-10-18-14)16(20-3)17(21-4)15(12)19-2/h6-7,9-11H,5,8H2,1-4H3
InChIKeyLNGRAOTYMNIKDY-UHFFFAOYSA-N
XLogP3.73
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-4-propyl-2-(4-pyridin-2-yl-1,2-oxazol-5-yl)phenol
CID 5207280
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CID 39226519
7-methoxy-6-propyl-3-pyridin-2-ylchromen-4-one
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1-[2,5-dipropyl-4-(3-pyridin-2-ylindol-1-yl)phenyl]-3-pyridin-2-ylindole
CID 59246591
ethane;3-propyl-2-pyridin-2-ylpyridine
CID 144702934
2-(2-butylphenyl)pyridine
CID 11977286
8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline
CID 21024858
2-methoxy-3-pyridin-2-ylaniline
CID 171626476
2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine
CID 175907027
(4-methoxy-3-pyridin-2-ylphenyl)methanamine
CID 82508814
5-propyl-3-pyridin-2-ylthiophen-2-amine
CID 60988143
2-(2-octylphenyl)pyridine
CID 15643012

Frequently Asked Questions

What is the IUPAC name of 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine?
The IUPAC name of 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine (CID 173295109) is 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine.
What is the SMILES notation for 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine?
The canonical SMILES for 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine is CCCc1cc(-c2ccccn2)c(OC)c(OC)c1OC.
What is the InChIKey of 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine?
The InChIKey is LNGRAOTYMNIKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO3/c1-5-8-12-11-13(14-9-6-7-10-18-14)16(20-3)17(21-4)15(12)19-2/h6-7,9-11H,5,8H2,1-4H3.
What are the key properties of 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine?
2-(2,3,4-trimethoxy-5-propylphenyl)pyridine has a molecular weight of 287.36 g/mol, XLogP of 3.73, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3,4-trimethoxy-5-propylphenyl)pyridine is sourced from PubChem (CID 173295109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).