[4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine

C15H18N2O — CID 81255400

IUPAC[4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine
SMILESCCc1cccc(Oc2cc(C)ncc2CN)c1
InChIInChI=1S/C15H18N2O/c1-3-12-5-4-6-14(8-12)18-15-7-11(2)17-10-13(15)9-16/h4-8,10H,3,9,16H2,1-2H3
InChIKeyFIMXHESYHHJQHY-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.20
Rot. Bonds4

About [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine

[4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine (PubChem CID 81255400) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine
PubChem CID81255400
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine
SMILESCCc1cccc(Oc2cc(C)ncc2CN)c1
InChIInChI=1S/C15H18N2O/c1-3-12-5-4-6-14(8-12)18-15-7-11(2)17-10-13(15)9-16/h4-8,10H,3,9,16H2,1-2H3
InChIKeyFIMXHESYHHJQHY-UHFFFAOYSA-N
XLogP3.20
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methyl]propan-2-amine
CID 81255097
3-[[5-(aminomethyl)-2-methyl-4-pyridinyl]oxy]-N,N-dimethylaniline
CID 81251021
[6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 81251268
[6-methyl-4-(4-methylsulfanylphenoxy)-3-pyridinyl]methanamine
CID 81250178
[2-(3-ethylphenoxy)-3-pyridinyl]methanamine
CID 24706317
[4-(3-bromo-4-fluorophenoxy)-6-methyl-3-pyridinyl]methanamine
CID 83235153
(4-ethoxy-6-methyl-3-pyridinyl)methanamine
CID 81255491
(6-methyl-4-quinolin-8-yloxy-3-pyridinyl)methanamine
CID 81251012
2-(3-ethylphenoxy)-5-methylpyridine
CID 135224750
[4-(2,4-difluorophenoxy)-6-methyl-3-pyridinyl]methanamine
CID 81254597
4-(4-chloro-3-ethylphenoxy)-5-(chloromethyl)-2-methylpyridine
CID 81233958
4-(chloromethyl)-3-(3-ethylphenoxy)pyridine
CID 105067622

Frequently Asked Questions

What is the IUPAC name of [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine?
The IUPAC name of [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine (CID 81255400) is [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine.
What is the SMILES notation for [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine?
The canonical SMILES for [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine is CCc1cccc(Oc2cc(C)ncc2CN)c1.
What is the InChIKey of [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine?
The InChIKey is FIMXHESYHHJQHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-3-12-5-4-6-14(8-12)18-15-7-11(2)17-10-13(15)9-16/h4-8,10H,3,9,16H2,1-2H3.
What are the key properties of [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine?
[4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine has a molecular weight of 242.32 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-ethylphenoxy)-6-methyl-3-pyridinyl]methanamine is sourced from PubChem (CID 81255400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).