1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine

C17H22N2O2 — CID 43206327

IUPAC1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine
SMILESCCC(NCc1ccc(OC)nc1)c1ccc(OC)cc1
InChIInChI=1S/C17H22N2O2/c1-4-16(14-6-8-15(20-2)9-7-14)18-11-13-5-10-17(21-3)19-12-13/h5-10,12,16,18H,4,11H2,1-3H3
InChIKeyABPUDMDLDCTZBI-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.34
Rot. Bonds7

About 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine

1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine (PubChem CID 43206327) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine
PubChem CID43206327
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine
SMILESCCC(NCc1ccc(OC)nc1)c1ccc(OC)cc1
InChIInChI=1S/C17H22N2O2/c1-4-16(14-6-8-15(20-2)9-7-14)18-11-13-5-10-17(21-3)19-12-13/h5-10,12,16,18H,4,11H2,1-3H3
InChIKeyABPUDMDLDCTZBI-UHFFFAOYSA-N
XLogP3.34
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-chlorophenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine
CID 43206298
N-[(6-methoxy-3-pyridinyl)methyl]-1-thiophen-2-ylpropan-1-amine
CID 43206362
N-[(6-methoxy-3-pyridinyl)methyl]heptan-3-amine
CID 63946078
4-methoxy-N-[(6-methoxy-3-pyridinyl)methyl]aniline
CID 114936317
3-[(6-methoxy-3-pyridinyl)methylamino]-3-phenylpropanenitrile
CID 62989925
1-(4-methoxyphenyl)-N-[2-(4-methoxyphenyl)ethyl]propan-1-amine
CID 43823991
N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-(4-methoxyphenyl)propan-1-amine
CID 103787067
1-(4-methoxyphenyl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-1-amine
CID 60776811
N-[(4-fluoro-3-methylphenyl)methyl]-1-(4-methoxyphenyl)propan-1-amine
CID 62121628
1-(4-fluoro-3-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]ethanamine
CID 82991116
4-bromo-2-[1-[(6-methoxy-3-pyridinyl)methylamino]propyl]phenol
CID 43097149
methyl 2-[(6-methoxy-3-pyridinyl)methylamino]butanoate
CID 113292334

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine?
The IUPAC name of 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine (CID 43206327) is 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine is CCC(NCc1ccc(OC)nc1)c1ccc(OC)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine?
The InChIKey is ABPUDMDLDCTZBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-4-16(14-6-8-15(20-2)9-7-14)18-11-13-5-10-17(21-3)19-12-13/h5-10,12,16,18H,4,11H2,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine?
1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine has a molecular weight of 286.38 g/mol, XLogP of 3.34, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-1-amine is sourced from PubChem (CID 43206327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).