2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine

C16H20N2O2 — CID 65445404

IUPAC2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine
SMILESCOc1ccc(CCNCc2ccnc(OC)c2)cc1
InChIInChI=1S/C16H20N2O2/c1-19-15-5-3-13(4-6-15)7-9-17-12-14-8-10-18-16(11-14)20-2/h3-6,8,10-11,17H,7,9,12H2,1-2H3
InChIKeySYLOXLUVRYWAPN-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.43
Rot. Bonds7

About 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine

2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine (PubChem CID 65445404) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine
PubChem CID65445404
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine
SMILESCOc1ccc(CCNCc2ccnc(OC)c2)cc1
InChIInChI=1S/C16H20N2O2/c1-19-15-5-3-13(4-6-15)7-9-17-12-14-8-10-18-16(11-14)20-2/h3-6,8,10-11,17H,7,9,12H2,1-2H3
InChIKeySYLOXLUVRYWAPN-UHFFFAOYSA-N
XLogP2.43
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
CID 18167253
N-[(4-methoxyphenyl)methyl]-2-(4-methylphenyl)ethanamine
CID 16753278
2-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]ethanamine
CID 2063770
2-(4-methoxyphenyl)-N-[(3-pyrimidin-2-yloxyphenyl)methyl]ethanamine
CID 17213608
4-[(2-methoxy-4-pyridinyl)methylamino]-2-methylbutan-2-ol
CID 79355566
2-(4-methoxyphenoxy)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 47019682
N-[(2-methoxy-4-pyridinyl)methyl]-3-methylsulfonylpropan-1-amine
CID 63191308
2-(4-methoxyphenyl)-N-(pyrimidin-5-ylmethyl)ethanamine
CID 62758750
N-[[4-(chloromethyl)phenyl]methyl]-2-(4-methoxyphenyl)ethanamine
CID 107232979
1-(2-methoxy-4-pyridinyl)-N-methylmethanamine;hydrochloride
CID 154963549
2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)ethanamine;hydrobromide
CID 75531303
2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)ethanamine;hydrochloride
CID 17292499

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine?
The IUPAC name of 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine (CID 65445404) is 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine?
The canonical SMILES for 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine is COc1ccc(CCNCc2ccnc(OC)c2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine?
The InChIKey is SYLOXLUVRYWAPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-19-15-5-3-13(4-6-15)7-9-17-12-14-8-10-18-16(11-14)20-2/h3-6,8,10-11,17H,7,9,12H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine?
2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine has a molecular weight of 272.35 g/mol, XLogP of 2.43, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 65445404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).