1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine

C16H20N2O — CID 106907968

IUPAC1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine
SMILESCCc1ccc(OCc2cccc(CNC)n2)cc1
InChIInChI=1S/C16H20N2O/c1-3-13-7-9-16(10-8-13)19-12-15-6-4-5-14(18-15)11-17-2/h4-10,17H,3,11-12H2,1-2H3
InChIKeyZNBHPCPGQBBWFL-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.94
Rot. Bonds6

About 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine

1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine (PubChem CID 106907968) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine
PubChem CID106907968
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine
SMILESCCc1ccc(OCc2cccc(CNC)n2)cc1
InChIInChI=1S/C16H20N2O/c1-3-13-7-9-16(10-8-13)19-12-15-6-4-5-14(18-15)11-17-2/h4-10,17H,3,11-12H2,1-2H3
InChIKeyZNBHPCPGQBBWFL-UHFFFAOYSA-N
XLogP2.94
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(4-ethylphenoxy)-2-pyridinyl]-N-methylmethanamine
CID 62298335
2-[(4-ethylphenoxy)methyl]-6-methoxypyridine
CID 64763644
N-methyl-1-[6-(quinolin-7-yloxymethyl)-2-pyridinyl]methanamine
CID 107315161
1-[6-(2,3-dihydro-1H-inden-5-yloxymethyl)-2-pyridinyl]-N-methylmethanamine
CID 106908170
1-[6-[(4-methoxyphenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 62291688
[6-[(4-propylphenoxy)methyl]-2-pyridinyl]methanamine
CID 106908300
1-methoxypropane;methyl 6-[(4-ethylphenoxy)methyl]pyridine-2-carboxylate
CID 143474444
1-[6-[(2-fluorophenoxy)methyl]-2-pyridinyl]-N-methylmethanamine
CID 106907979
N-methyl-1-[6-[(2,3,6-trimethylphenoxy)methyl]-2-pyridinyl]methanamine
CID 106908199
1-[4-[(2-ethyl-1,3-thiazol-4-yl)methoxy]phenyl]-N-methylmethanamine
CID 54955994
1-[6-[(2-bromo-5-fluorophenoxy)methyl]-2-pyridinyl]-N-methylmethanamine
CID 106908545
N-methyl-1-[3-[(6-methyl-2-pyridinyl)methoxy]phenyl]methanamine
CID 79268111

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine (CID 106907968) is 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine is CCc1ccc(OCc2cccc(CNC)n2)cc1.
What is the InChIKey of 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine?
The InChIKey is ZNBHPCPGQBBWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-3-13-7-9-16(10-8-13)19-12-15-6-4-5-14(18-15)11-17-2/h4-10,17H,3,11-12H2,1-2H3.
What are the key properties of 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine?
1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine has a molecular weight of 256.35 g/mol, XLogP of 2.94, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(4-ethylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 106907968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).