N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine

C17H22N2O — CID 62161192

IUPACN-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine
SMILESCCNC(Cc1cc(C)ccc1OC)c1ccncc1
InChIInChI=1S/C17H22N2O/c1-4-19-16(14-7-9-18-10-8-14)12-15-11-13(2)5-6-17(15)20-3/h5-11,16,19H,4,12H2,1-3H3
InChIKeyXHISTIZXRAEOOQ-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.29
Rot. Bonds6

About N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine

N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine (PubChem CID 62161192) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine.

Molecular Properties

Compound NameN-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine
PubChem CID62161192
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine
SMILESCCNC(Cc1cc(C)ccc1OC)c1ccncc1
InChIInChI=1S/C17H22N2O/c1-4-19-16(14-7-9-18-10-8-14)12-15-11-13(2)5-6-17(15)20-3/h5-11,16,19H,4,12H2,1-3H3
InChIKeyXHISTIZXRAEOOQ-UHFFFAOYSA-N
XLogP3.29
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 ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(3-iodophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine
CID 115826666
N-ethyl-2-(2-methoxy-5-methylphenyl)-1-(4-methylthiadiazol-5-yl)ethanamine
CID 105118074
1-(1,5-dimethylpyrazol-4-yl)-N-ethyl-2-(2-methoxy-5-methylphenyl)ethanamine
CID 105118243
2-(5-chloro-2-methoxyphenyl)-1-(4-chlorophenyl)-N-ethylethanamine
CID 63414164
N-ethyl-3-(2-methoxy-5-methylphenyl)-1-phenylpropan-1-amine
CID 62159966
N-[2-(2-methoxy-5-methylphenyl)-1-pyrimidin-4-ylethyl]propan-1-amine
CID 63989184
2-(2-methoxy-5-methylphenyl)-1-(3-methoxy-4-pyridinyl)-N-methylethanamine
CID 105065334
2-(2-methoxy-5-methylphenyl)-N-methyl-1-pyrazin-2-ylethanamine
CID 62160695
2-(5-chloro-2-methoxyphenyl)-N-ethyl-1-pyrimidin-5-ylethanamine
CID 102923380
N-ethyl-2-(2-methoxyphenyl)-1-(2-methyl-4-pyridinyl)ethanamine
CID 106754986
1-(3-chloro-4-methylthiophen-2-yl)-N-ethyl-2-(2-methoxy-5-methylphenyl)ethanamine
CID 103405432
N-ethyl-2-(2-methoxy-5-methylphenyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
CID 115826696

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine?
The IUPAC name of N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine (CID 62161192) is N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine.
What is the SMILES notation for N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine?
The canonical SMILES for N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine is CCNC(Cc1cc(C)ccc1OC)c1ccncc1.
What is the InChIKey of N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine?
The InChIKey is XHISTIZXRAEOOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-4-19-16(14-7-9-18-10-8-14)12-15-11-13(2)5-6-17(15)20-3/h5-11,16,19H,4,12H2,1-3H3.
What are the key properties of N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine?
N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine has a molecular weight of 270.38 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine is sourced from PubChem (CID 62161192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).