2-methyl-6-pentoxypyridine

C11H17NO — CID 165358855

IUPAC2-methyl-6-pentoxypyridine
SMILESCCCCCOc1cccc(C)n1
InChIInChI=1S/C11H17NO/c1-3-4-5-9-13-11-8-6-7-10(2)12-11/h6-8H,3-5,9H2,1-2H3
InChIKeySYXCPSUQMOFPCC-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.96
Rot. Bonds5

About 2-methyl-6-pentoxypyridine

2-methyl-6-pentoxypyridine (PubChem CID 165358855) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 2-methyl-6-pentoxypyridine.

Molecular Properties

Compound Name2-methyl-6-pentoxypyridine
PubChem CID165358855
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name2-methyl-6-pentoxypyridine
SMILESCCCCCOc1cccc(C)n1
InChIInChI=1S/C11H17NO/c1-3-4-5-9-13-11-8-6-7-10(2)12-11/h6-8H,3-5,9H2,1-2H3
InChIKeySYXCPSUQMOFPCC-UHFFFAOYSA-N
XLogP2.96
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.96
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

2,6-dibutoxypyridine
CID 67437244
(6-pentoxy-2-pyridinyl)methanamine
CID 62292615
6-pentoxypyridine-2-carbonitrile
CID 64594194
2-(chloromethyl)-6-heptoxypyridine
CID 63446220
ethane;N-[3-[(6-methyl-2-pyridinyl)oxy]propyl]pentan-3-amine
CID 142114829
1-(6-hexoxy-2-pyridinyl)-N-methylmethanamine
CID 62291660
2-(methoxymethoxy)-6-methylpyridine
CID 150228028
N-[(6-pentoxy-2-pyridinyl)methyl]propan-2-amine
CID 55058638
2-methyl-6-(pyridin-2-ylmethoxy)pyridine
CID 86815736
6-butoxy-N-ethylpyridin-2-amine
CID 80867318
6-heptoxypyridine-2-carboximidamide
CID 64594210
6-butoxy-N-tert-butylpyridin-2-amine
CID 115498673

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-pentoxypyridine?
The IUPAC name of 2-methyl-6-pentoxypyridine (CID 165358855) is 2-methyl-6-pentoxypyridine.
What is the SMILES notation for 2-methyl-6-pentoxypyridine?
The canonical SMILES for 2-methyl-6-pentoxypyridine is CCCCCOc1cccc(C)n1.
What is the InChIKey of 2-methyl-6-pentoxypyridine?
The InChIKey is SYXCPSUQMOFPCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-3-4-5-9-13-11-8-6-7-10(2)12-11/h6-8H,3-5,9H2,1-2H3.
What are the key properties of 2-methyl-6-pentoxypyridine?
2-methyl-6-pentoxypyridine has a molecular weight of 179.26 g/mol, XLogP of 2.96, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-pentoxypyridine is sourced from PubChem (CID 165358855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).