2-(3-methoxypropyl)-3-methylpyridine

C10H15NO — CID 90669004

IUPAC2-(3-methoxypropyl)-3-methylpyridine
SMILESCOCCCc1ncccc1C
InChIInChI=1S/C10H15NO/c1-9-5-3-7-11-10(9)6-4-8-12-2/h3,5,7H,4,6,8H2,1-2H3
InChIKeyMASDLDIUCDOYKP-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.97
Rot. Bonds4

About 2-(3-methoxypropyl)-3-methylpyridine

2-(3-methoxypropyl)-3-methylpyridine (PubChem CID 90669004) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-(3-methoxypropyl)-3-methylpyridine.

Molecular Properties

Compound Name2-(3-methoxypropyl)-3-methylpyridine
PubChem CID90669004
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-(3-methoxypropyl)-3-methylpyridine
SMILESCOCCCc1ncccc1C
InChIInChI=1S/C10H15NO/c1-9-5-3-7-11-10(9)6-4-8-12-2/h3,5,7H,4,6,8H2,1-2H3
InChIKeyMASDLDIUCDOYKP-UHFFFAOYSA-N
XLogP1.97
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Myosmine
CID 442649
5-Ethyl-2-methylpyridine
CID 7728
Anabaseine
CID 18985
2,4-Dimethylpyridine
CID 7936
2-Propylpyridine
CID 69320
3-Butylpyridine
CID 10874
3-Pentylpyridine
CID 238307
2-(3-Phenylpropyl)Pyridine
CID 459494
2-Pentylpyridine
CID 16800
2-(2-Hydroxyethyl)pyridine
CID 7675
3-Pyridinepropanol
CID 17861
2-Isobutylpyridine
CID 61385

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypropyl)-3-methylpyridine?
The IUPAC name of 2-(3-methoxypropyl)-3-methylpyridine (CID 90669004) is 2-(3-methoxypropyl)-3-methylpyridine.
What is the SMILES notation for 2-(3-methoxypropyl)-3-methylpyridine?
The canonical SMILES for 2-(3-methoxypropyl)-3-methylpyridine is COCCCc1ncccc1C.
What is the InChIKey of 2-(3-methoxypropyl)-3-methylpyridine?
The InChIKey is MASDLDIUCDOYKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-9-5-3-7-11-10(9)6-4-8-12-2/h3,5,7H,4,6,8H2,1-2H3.
What are the key properties of 2-(3-methoxypropyl)-3-methylpyridine?
2-(3-methoxypropyl)-3-methylpyridine has a molecular weight of 165.24 g/mol, XLogP of 1.97, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypropyl)-3-methylpyridine is sourced from PubChem (CID 90669004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).