[2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine

C15H18N2O — CID 81050871

IUPAC[2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine
SMILESCc1cc(Oc2ccccc2C)c(CN)c(C)n1
InChIInChI=1S/C15H18N2O/c1-10-6-4-5-7-14(10)18-15-8-11(2)17-12(3)13(15)9-16/h4-8H,9,16H2,1-3H3
InChIKeyFOLCPWIVALNHNB-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.26
Rot. Bonds3

About [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine

[2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine (PubChem CID 81050871) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine
PubChem CID81050871
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine
SMILESCc1cc(Oc2ccccc2C)c(CN)c(C)n1
InChIInChI=1S/C15H18N2O/c1-10-6-4-5-7-14(10)18-15-8-11(2)17-12(3)13(15)9-16/h4-8H,9,16H2,1-3H3
InChIKeyFOLCPWIVALNHNB-UHFFFAOYSA-N
XLogP3.26
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine?
The IUPAC name of [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine (CID 81050871) is [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine.
What is the SMILES notation for [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine?
The canonical SMILES for [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine is Cc1cc(Oc2ccccc2C)c(CN)c(C)n1.
What is the InChIKey of [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine?
The InChIKey is FOLCPWIVALNHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-10-6-4-5-7-14(10)18-15-8-11(2)17-12(3)13(15)9-16/h4-8H,9,16H2,1-3H3.
What are the key properties of [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine?
[2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine has a molecular weight of 242.32 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2,6-dimethyl-4-(2-methylphenoxy)-3-pyridinyl]methanamine is sourced from PubChem (CID 81050871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).