N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine

C17H22N2O — CID 116773113

IUPACN-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine
SMILESCCNC(c1cnccc1C)C(OC)c1ccccc1
InChIInChI=1S/C17H22N2O/c1-4-19-16(15-12-18-11-10-13(15)2)17(20-3)14-8-6-5-7-9-14/h5-12,16-17,19H,4H2,1-3H3
InChIKeyDNYQEXAZUSHZIL-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.43
Rot. Bonds6

About N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine

N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine (PubChem CID 116773113) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine
PubChem CID116773113
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine
SMILESCCNC(c1cnccc1C)C(OC)c1ccccc1
InChIInChI=1S/C17H22N2O/c1-4-19-16(15-12-18-11-10-13(15)2)17(20-3)14-8-6-5-7-9-14/h5-12,16-17,19H,4H2,1-3H3
InChIKeyDNYQEXAZUSHZIL-UHFFFAOYSA-N
XLogP3.43
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine
CID 116773275
N-ethyl-1-(2-fluorophenyl)-2-methoxy-2-phenylethanamine
CID 116773160
N-ethyl-2-methoxy-1-(1-methylpyrazol-4-yl)-2-phenylethanamine
CID 116773030
N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)-2-phenylethanamine
CID 116773182
N-ethyl-2-methoxy-2-phenyl-1-(1-propylpyrazol-4-yl)ethanamine
CID 116773141
2-methoxy-N-methyl-1-(4-methyl-3-pyridinyl)butan-1-amine
CID 116715414
1-(3,4-difluorophenyl)-N-ethyl-2-methoxy-2-phenylethanamine
CID 116773143
1-(4-bromo-1-ethylpyrazol-5-yl)-N-ethyl-2-methoxy-2-phenylethanamine
CID 114662155
N-ethyl-3-methyl-1-(4-methyl-3-pyridinyl)butan-1-amine
CID 66272697
1-(3-bromothiophen-2-yl)-N-ethyl-2-methoxy-2-phenylethanamine
CID 116773064
N-ethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine
CID 79405563
N-[(4-methyl-3-pyridinyl)-(2-propan-2-yloxyphenyl)methyl]ethanamine
CID 114878306

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine?
The IUPAC name of N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine (CID 116773113) is N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine.
What is the SMILES notation for N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine?
The canonical SMILES for N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine is CCNC(c1cnccc1C)C(OC)c1ccccc1.
What is the InChIKey of N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine?
The InChIKey is DNYQEXAZUSHZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-4-19-16(15-12-18-11-10-13(15)2)17(20-3)14-8-6-5-7-9-14/h5-12,16-17,19H,4H2,1-3H3.
What are the key properties of N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine?
N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine has a molecular weight of 270.38 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine is sourced from PubChem (CID 116773113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).