2-(methoxymethyl)-5-(2-methylpentyl)pyridine

C13H21NO — CID 134277160

IUPAC2-(methoxymethyl)-5-(2-methylpentyl)pyridine
SMILESCCCC(C)Cc1ccc(COC)nc1
InChIInChI=1S/C13H21NO/c1-4-5-11(2)8-12-6-7-13(10-15-3)14-9-12/h6-7,9,11H,4-5,8,10H2,1-3H3
InChIKeyHHXCMYZVXWUIDH-UHFFFAOYSA-N
MW207.32 g/mol
LogP3.21
Rot. Bonds6

About 2-(methoxymethyl)-5-(2-methylpentyl)pyridine

2-(methoxymethyl)-5-(2-methylpentyl)pyridine (PubChem CID 134277160) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-(methoxymethyl)-5-(2-methylpentyl)pyridine.

Molecular Properties

Compound Name2-(methoxymethyl)-5-(2-methylpentyl)pyridine
PubChem CID134277160
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name2-(methoxymethyl)-5-(2-methylpentyl)pyridine
SMILESCCCC(C)Cc1ccc(COC)nc1
InChIInChI=1S/C13H21NO/c1-4-5-11(2)8-12-6-7-13(10-15-3)14-9-12/h6-7,9,11H,4-5,8,10H2,1-3H3
InChIKeyHHXCMYZVXWUIDH-UHFFFAOYSA-N
XLogP3.21
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-methylpentyl)pyridin-2-amine
CID 129191310
2-methyl-N-[[6-(2-methylpentoxymethyl)-3-pyridinyl]methyl]propan-1-amine
CID 103285679
2-ethyl-5-(2-methylpropyl)pyridine
CID 126548709
2-methoxy-5-(2-methylpentyl)phenol
CID 154974152
2-fluoro-1-methoxy-4-[(2R)-2-methylpentyl]benzene
CID 59468307
3-(5-ethyl-2-pyridinyl)-2-methylpropan-1-amine
CID 81020364
1-(5-ethyl-2-pyridinyl)-5-methoxy-4-methyl-N-propylpentan-2-amine
CID 105168927
(2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine
CID 104932333
N-[[6-[2-(2-methylpropoxy)ethoxymethyl]-3-pyridinyl]methyl]propan-1-amine
CID 106450090
N-methyl-5-(2-methylpentoxymethyl)pyridin-2-amine
CID 103285298
N-[[5-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79781493
2-chloro-5-[(2S)-2-methylbutyl]pyridine
CID 56840075

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-5-(2-methylpentyl)pyridine?
The IUPAC name of 2-(methoxymethyl)-5-(2-methylpentyl)pyridine (CID 134277160) is 2-(methoxymethyl)-5-(2-methylpentyl)pyridine.
What is the SMILES notation for 2-(methoxymethyl)-5-(2-methylpentyl)pyridine?
The canonical SMILES for 2-(methoxymethyl)-5-(2-methylpentyl)pyridine is CCCC(C)Cc1ccc(COC)nc1.
What is the InChIKey of 2-(methoxymethyl)-5-(2-methylpentyl)pyridine?
The InChIKey is HHXCMYZVXWUIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-4-5-11(2)8-12-6-7-13(10-15-3)14-9-12/h6-7,9,11H,4-5,8,10H2,1-3H3.
What are the key properties of 2-(methoxymethyl)-5-(2-methylpentyl)pyridine?
2-(methoxymethyl)-5-(2-methylpentyl)pyridine has a molecular weight of 207.32 g/mol, XLogP of 3.21, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-5-(2-methylpentyl)pyridine is sourced from PubChem (CID 134277160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).