1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine

C16H20N2O — CID 65313099

IUPAC1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
SMILESCNC(Cc1cccnc1)c1ccc(OC)cc1C
InChIInChI=1S/C16H20N2O/c1-12-9-14(19-3)6-7-15(12)16(17-2)10-13-5-4-8-18-11-13/h4-9,11,16-17H,10H2,1-3H3
InChIKeyAUVKUODMKDZPKJ-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.90
Rot. Bonds5

About 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine

1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine (PubChem CID 65313099) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
PubChem CID65313099
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
SMILESCNC(Cc1cccnc1)c1ccc(OC)cc1C
InChIInChI=1S/C16H20N2O/c1-12-9-14(19-3)6-7-15(12)16(17-2)10-13-5-4-8-18-11-13/h4-9,11,16-17H,10H2,1-3H3
InChIKeyAUVKUODMKDZPKJ-UHFFFAOYSA-N
XLogP2.90
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-pyridin-3-yl-1-(2,4,5-trimethylphenyl)ethanamine
CID 64990106
1-(4-methoxy-2-methylphenyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 43482745
1-(2-methoxy-5-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 62794931
1-(2,3-difluoro-4-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 107513287
1-(2,5-dimethylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 62549906
1-(4-methoxy-2-methylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 105115823
1-(2-fluoro-4-methoxyphenyl)-N-methyl-3-pyridin-3-ylpropan-1-amine
CID 103397402
1-(5-chloro-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 105034593
1-(3,4-dimethylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 62549735
1-(4-methoxy-2-methylphenyl)-2-(2-methoxyphenyl)-N-methylethanamine
CID 43482757
1-(3-chloro-4-pyridinyl)-2-(3-methoxyphenyl)-N-methylethanamine
CID 105133902
1-(4-methoxy-2-methylphenyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
CID 114878225

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine?
The IUPAC name of 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine (CID 65313099) is 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine is CNC(Cc1cccnc1)c1ccc(OC)cc1C.
What is the InChIKey of 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine?
The InChIKey is AUVKUODMKDZPKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-12-9-14(19-3)6-7-15(12)16(17-2)10-13-5-4-8-18-11-13/h4-9,11,16-17H,10H2,1-3H3.
What are the key properties of 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine?
1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine has a molecular weight of 256.35 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine is sourced from PubChem (CID 65313099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).