1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine

C15H18N2O — CID 63155861

IUPAC1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
SMILESCNC(c1ccc(OC)cc1)c1ccc(C)nc1
InChIInChI=1S/C15H18N2O/c1-11-4-5-13(10-17-11)15(16-2)12-6-8-14(18-3)9-7-12/h4-10,15-16H,1-3H3
InChIKeyJMRDAVKKTBBKNS-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.71
Rot. Bonds4

About 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine

1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine (PubChem CID 63155861) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
PubChem CID63155861
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
SMILESCNC(c1ccc(OC)cc1)c1ccc(C)nc1
InChIInChI=1S/C15H18N2O/c1-11-4-5-13(10-17-11)15(16-2)12-6-8-14(18-3)9-7-12/h4-10,15-16H,1-3H3
InChIKeyJMRDAVKKTBBKNS-UHFFFAOYSA-N
XLogP2.71
TPSA34.15 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 ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine?
The IUPAC name of 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine (CID 63155861) is 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine is CNC(c1ccc(OC)cc1)c1ccc(C)nc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine?
The InChIKey is JMRDAVKKTBBKNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11-4-5-13(10-17-11)15(16-2)12-6-8-14(18-3)9-7-12/h4-10,15-16H,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine?
1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine has a molecular weight of 242.32 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine is sourced from PubChem (CID 63155861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).