1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine

C15H18N2O — CID 62791020

IUPAC1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine
SMILESCCOc1ccc(C(NC)c2ccccn2)cc1
InChIInChI=1S/C15H18N2O/c1-3-18-13-9-7-12(8-10-13)15(16-2)14-6-4-5-11-17-14/h4-11,15-16H,3H2,1-2H3
InChIKeyXVGCJXQWROTVQN-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.79
Rot. Bonds5

About 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine

1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine (PubChem CID 62791020) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine
PubChem CID62791020
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine
SMILESCCOc1ccc(C(NC)c2ccccn2)cc1
InChIInChI=1S/C15H18N2O/c1-3-18-13-9-7-12(8-10-13)15(16-2)14-6-4-5-11-17-14/h4-11,15-16H,3H2,1-2H3
InChIKeyXVGCJXQWROTVQN-UHFFFAOYSA-N
XLogP2.79
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-ethoxyphenyl)-N-methyl-1-(6-methyl-2-pyridinyl)methanamine
CID 55222444
1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine
CID 55120655
1-(4-ethoxyphenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 105032032
4-[methylamino(pyridin-2-yl)methyl]benzoic acid
CID 116953941
1-(4-ethoxyphenyl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 105140831
1-(3,4-dichlorophenyl)-1-(4-ethoxyphenyl)-N-methylmethanamine
CID 43481911
1-(3,4-difluorophenyl)-N-methyl-1-pyridin-2-ylmethanamine
CID 62802022
N-methyl-1-(2-propoxyphenyl)-1-pyridin-2-ylmethanamine
CID 104659848
1-(3-chloro-4-pyridinyl)-1-(4-ethoxyphenyl)-N-methylmethanamine
CID 105140857
1-(4-ethoxyphenyl)-N-methyl-1-(2,4,5-trimethylphenyl)methanamine
CID 104990532
N-methyl-1-(3-methyl-2-pyridinyl)-1-(4-propoxyphenyl)methanamine
CID 62796820
1-(2-fluorophenyl)-N-methyl-1-pyridin-2-ylmethanamine
CID 62500784

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine?
The IUPAC name of 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine (CID 62791020) is 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine.
What is the SMILES notation for 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine?
The canonical SMILES for 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine is CCOc1ccc(C(NC)c2ccccn2)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine?
The InChIKey is XVGCJXQWROTVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-3-18-13-9-7-12(8-10-13)15(16-2)14-6-4-5-11-17-14/h4-11,15-16H,3H2,1-2H3.
What are the key properties of 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine?
1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine has a molecular weight of 242.32 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine is sourced from PubChem (CID 62791020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).