3-methyl-5-(3-propoxyphenyl)pyridine

C15H17NO — CID 143608383

IUPAC3-methyl-5-(3-propoxyphenyl)pyridine
SMILESCCCOc1cccc(-c2cncc(C)c2)c1
InChIInChI=1S/C15H17NO/c1-3-7-17-15-6-4-5-13(9-15)14-8-12(2)10-16-11-14/h4-6,8-11H,3,7H2,1-2H3
InChIKeyHBWQHHGCZWSMSY-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.85
Rot. Bonds4

About 3-methyl-5-(3-propoxyphenyl)pyridine

3-methyl-5-(3-propoxyphenyl)pyridine (PubChem CID 143608383) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-methyl-5-(3-propoxyphenyl)pyridine.

Molecular Properties

Compound Name3-methyl-5-(3-propoxyphenyl)pyridine
PubChem CID143608383
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name3-methyl-5-(3-propoxyphenyl)pyridine
SMILESCCCOc1cccc(-c2cncc(C)c2)c1
InChIInChI=1S/C15H17NO/c1-3-7-17-15-6-4-5-13(9-15)14-8-12(2)10-16-11-14/h4-6,8-11H,3,7H2,1-2H3
InChIKeyHBWQHHGCZWSMSY-UHFFFAOYSA-N
XLogP3.85
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-methylphenyl)-5-(3-propoxyphenyl)-1,2,4-oxadiazole
CID 46300212
2-methyl-6-(3-propoxyphenyl)pyridin-3-amine
CID 82467694
3-methyl-5-(5-pyridin-3-yl-3-pyridinyl)pyridine
CID 170233955
8-methyl-2-(3-propoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 63617454
2-methyl-4-(3-propoxyphenyl)-1,3-thiazol-5-amine
CID 62498658
trifluoro-(3-propoxyphenyl)boranuide
CID 63676814
2-ethyl-4-(3-propoxyphenyl)imidazole-1,5-diamine
CID 55079214
N,6-dimethyl-2-(3-propoxyphenyl)pyrimidin-4-amine
CID 62499474
5-iodo-6-methyl-2-(3-propoxyphenyl)pyrimidin-4-amine
CID 66296695
N-ethylmethanimine;1-methyl-3-propoxybenzene
CID 157286038
3-bromo-5-(3-propoxyphenyl)-1,2,4-oxadiazole
CID 112571624
3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine
CID 71141792

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(3-propoxyphenyl)pyridine?
The IUPAC name of 3-methyl-5-(3-propoxyphenyl)pyridine (CID 143608383) is 3-methyl-5-(3-propoxyphenyl)pyridine.
What is the SMILES notation for 3-methyl-5-(3-propoxyphenyl)pyridine?
The canonical SMILES for 3-methyl-5-(3-propoxyphenyl)pyridine is CCCOc1cccc(-c2cncc(C)c2)c1.
What is the InChIKey of 3-methyl-5-(3-propoxyphenyl)pyridine?
The InChIKey is HBWQHHGCZWSMSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-3-7-17-15-6-4-5-13(9-15)14-8-12(2)10-16-11-14/h4-6,8-11H,3,7H2,1-2H3.
What are the key properties of 3-methyl-5-(3-propoxyphenyl)pyridine?
3-methyl-5-(3-propoxyphenyl)pyridine has a molecular weight of 227.31 g/mol, XLogP of 3.85, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(3-propoxyphenyl)pyridine is sourced from PubChem (CID 143608383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).