N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine

C16H28N2O2 — CID 103035933

IUPACN-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine
SMILESCCNC(CCC(C)(C)OC)Cc1ccc(OC)nc1
InChIInChI=1S/C16H28N2O2/c1-6-17-14(9-10-16(2,3)20-5)11-13-7-8-15(19-4)18-12-13/h7-8,12,14,17H,6,9-11H2,1-5H3
InChIKeyTWCDKVDDLSPSKX-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.82
Rot. Bonds9

About N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine

N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine (PubChem CID 103035933) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine.

Molecular Properties

Compound NameN-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine
PubChem CID103035933
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine
SMILESCCNC(CCC(C)(C)OC)Cc1ccc(OC)nc1
InChIInChI=1S/C16H28N2O2/c1-6-17-14(9-10-16(2,3)20-5)11-13-7-8-15(19-4)18-12-13/h7-8,12,14,17H,6,9-11H2,1-5H3
InChIKeyTWCDKVDDLSPSKX-UHFFFAOYSA-N
XLogP2.82
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-5-methoxy-1-(3-methoxyphenyl)-5-methylhexan-2-amine
CID 103031663
N-ethyl-1-(furan-2-yl)-3-(6-methoxy-3-pyridinyl)propan-2-amine
CID 83182860
N-ethyl-7-methoxy-2,2,7-trimethyloctan-4-amine
CID 103031647
4-methoxy-1-(6-methoxy-3-pyridinyl)-4-methylpentan-1-ol
CID 103035297
1-(3,4-dimethylphenyl)-5-methoxy-5-methyl-N-propylhexan-2-amine
CID 103031493
(2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine
CID 104932333
[1-(6-methoxy-3-pyridinyl)-6-methylheptan-2-yl]hydrazine
CID 105250649
N-[(6-methoxy-3-pyridinyl)methyl]heptan-3-amine
CID 63946078
1-(2-chloro-6-fluorophenyl)-N-ethyl-5-methoxy-5-methylhexan-2-amine
CID 103031888
N-ethyl-1-[6-(3-methoxy-3-methylbutoxy)-3-pyridinyl]ethanamine
CID 106665931
N-[(6-methoxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62292084
1-(benzimidazol-1-yl)-N-ethyl-5-methoxy-5-methylhexan-2-amine
CID 103031480

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine?
The IUPAC name of N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine (CID 103035933) is N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine.
What is the SMILES notation for N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine?
The canonical SMILES for N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine is CCNC(CCC(C)(C)OC)Cc1ccc(OC)nc1.
What is the InChIKey of N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine?
The InChIKey is TWCDKVDDLSPSKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-6-17-14(9-10-16(2,3)20-5)11-13-7-8-15(19-4)18-12-13/h7-8,12,14,17H,6,9-11H2,1-5H3.
What are the key properties of N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine?
N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine has a molecular weight of 280.41 g/mol, XLogP of 2.82, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methoxy-1-(6-methoxy-3-pyridinyl)-5-methylhexan-2-amine is sourced from PubChem (CID 103035933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).