2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine

C15H18N2O — CID 112651124

IUPAC2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
SMILESCc1cccnc1COc1ccccc1CCN
InChIInChI=1S/C15H18N2O/c1-12-5-4-10-17-14(12)11-18-15-7-3-2-6-13(15)8-9-16/h2-7,10H,8-9,11,16H2,1H3
InChIKeyKLMLUWRHSOQIPQ-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.47
Rot. Bonds5

About 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine

2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine (PubChem CID 112651124) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound Name2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
PubChem CID112651124
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
SMILESCc1cccnc1COc1ccccc1CCN
InChIInChI=1S/C15H18N2O/c1-12-5-4-10-17-14(12)11-18-15-7-3-2-6-13(15)8-9-16/h2-7,10H,8-9,11,16H2,1H3
InChIKeyKLMLUWRHSOQIPQ-UHFFFAOYSA-N
XLogP2.47
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-bromo-2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
CID 112651125
[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]methanol
CID 112650634
2-[(2-iodophenoxy)methyl]-3-methylpyridine
CID 112549846
2-[2-[2-(2-methylphenoxy)ethoxy]phenyl]ethanamine
CID 22680049
[2-fluoro-6-[(3-methyl-2-pyridinyl)methoxy]phenyl]methanamine
CID 112649743
3-methyl-2-[(2-propan-2-ylphenoxy)methyl]pyridine
CID 112651495
trifluoro-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]boranuide
CID 115982170
2-[(3-methyl-2-pyridinyl)methoxy]benzonitrile
CID 112549824
2-[2-[(2,3-dimethylphenoxy)methyl]phenyl]ethanamine
CID 115464752
[2-[(2-methoxyphenoxy)methyl]-3-pyridinyl]methanamine
CID 114199233
[2-[(2-fluorophenoxy)methyl]-3-pyridinyl]methanamine
CID 114199215
3-methyl-2-[(3-methyl-2-pyridinyl)methoxymethyl]pyridine
CID 142776988

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine?
The IUPAC name of 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine (CID 112651124) is 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine.
What is the SMILES notation for 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine?
The canonical SMILES for 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine is Cc1cccnc1COc1ccccc1CCN.
What is the InChIKey of 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine?
The InChIKey is KLMLUWRHSOQIPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-12-5-4-10-17-14(12)11-18-15-7-3-2-6-13(15)8-9-16/h2-7,10H,8-9,11,16H2,1H3.
What are the key properties of 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine?
2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine has a molecular weight of 242.32 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 112651124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).