1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine

C16H28N2O — CID 105169027

IUPAC1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine
SMILESCCCNC(COC(C)C)Cc1ccc(CC)cn1
InChIInChI=1S/C16H28N2O/c1-5-9-17-16(12-19-13(3)4)10-15-8-7-14(6-2)11-18-15/h7-8,11,13,16-17H,5-6,9-10,12H2,1-4H3
InChIKeyXCHSTFCFUWASEH-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.98
Rot. Bonds9

About 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine

1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine (PubChem CID 105169027) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine.

Molecular Properties

Compound Name1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine
PubChem CID105169027
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine
SMILESCCCNC(COC(C)C)Cc1ccc(CC)cn1
InChIInChI=1S/C16H28N2O/c1-5-9-17-16(12-19-13(3)4)10-15-8-7-14(6-2)11-18-15/h7-8,11,13,16-17H,5-6,9-10,12H2,1-4H3
InChIKeyXCHSTFCFUWASEH-UHFFFAOYSA-N
XLogP2.98
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-ethyl-2-pyridinyl)-5-methoxy-4-methyl-N-propylpentan-2-amine
CID 105168927
1-(5-ethyl-2-pyridinyl)-N-propylhexan-2-amine
CID 79747783
1-(5-ethyl-2-pyridinyl)-4,5,5-trimethyl-N-propylhexan-2-amine
CID 105014705
1-(5-ethyl-2-pyridinyl)-5,5,5-trifluoro-N-propylpentan-2-amine
CID 79954795
N-ethyl-1-(5-ethyl-2-pyridinyl)-4-methylpentan-2-amine
CID 79748669
1-propan-2-yloxy-N-propyl-3-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 105013266
1-(3,4-difluorophenyl)-3-propan-2-yloxy-N-propylpropan-2-amine
CID 105013377
1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine
CID 79006788
[1-(5-ethyl-2-pyridinyl)-3-propoxypropan-2-yl]hydrazine
CID 105209932
N-[2-(5-ethyl-2-pyridinyl)-1-(4-methylphenyl)ethyl]propan-1-amine
CID 79732889
N-ethyl-1-(5-ethyl-2-pyridinyl)-5-methoxyhexan-2-amine
CID 105168893
N-ethyl-1-(5-ethyl-2-pyridinyl)-4-propoxybutan-2-amine
CID 105168889

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine?
The IUPAC name of 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine (CID 105169027) is 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine.
What is the SMILES notation for 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine?
The canonical SMILES for 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine is CCCNC(COC(C)C)Cc1ccc(CC)cn1.
What is the InChIKey of 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine?
The InChIKey is XCHSTFCFUWASEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-5-9-17-16(12-19-13(3)4)10-15-8-7-14(6-2)11-18-15/h7-8,11,13,16-17H,5-6,9-10,12H2,1-4H3.
What are the key properties of 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine?
1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine has a molecular weight of 264.41 g/mol, XLogP of 2.98, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-2-pyridinyl)-3-propan-2-yloxy-N-propylpropan-2-amine is sourced from PubChem (CID 105169027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).