1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine

C16H22N2S — CID 63773530

IUPAC1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
SMILESCCCNC(CCc1cccs1)c1cccc(C)n1
InChIInChI=1S/C16H22N2S/c1-3-11-17-15(10-9-14-7-5-12-19-14)16-8-4-6-13(2)18-16/h4-8,12,15,17H,3,9-11H2,1-2H3
InChIKeyAIMRYPJEFMDPGX-UHFFFAOYSA-N
MW274.43 g/mol
LogP4.13
Rot. Bonds7

About 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine

1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine (PubChem CID 63773530) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
PubChem CID63773530
Molecular FormulaC16H22N2S
Molecular Weight274.43 g/mol
Exact Mass274.15
IUPAC Name1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
SMILESCCCNC(CCc1cccs1)c1cccc(C)n1
InChIInChI=1S/C16H22N2S/c1-3-11-17-15(10-9-14-7-5-12-19-14)16-8-4-6-13(2)18-16/h4-8,12,15,17H,3,9-11H2,1-2H3
InChIKeyAIMRYPJEFMDPGX-UHFFFAOYSA-N
XLogP4.13
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(6-methyl-2-pyridinyl)-2-thiophen-2-ylethanamine
CID 63555608
1-(2-methyltriazol-4-yl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 112735841
1-(5-fluoro-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 79712986
1-(6-methoxypyrimidin-4-yl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 102952185
1-(4,5-dimethylthiophen-2-yl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 115860668
1-(4-iodophenyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 115861151
1-(3-bromophenyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 63774616
1-(2-chlorophenyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 63775444
1-(3-chloro-4-methylphenyl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 115860699
1-(5-bromo-4-methylthiophen-2-yl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 115860725
1-(1-benzothiophen-3-yl)-N-propyl-3-thiophen-2-ylpropan-1-amine
CID 115860702
1,1-dimethoxy-N-propyl-4-thiophen-2-ylbutan-2-amine
CID 79493483

Frequently Asked Questions

What is the IUPAC name of 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine?
The IUPAC name of 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine (CID 63773530) is 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine?
The canonical SMILES for 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine is CCCNC(CCc1cccs1)c1cccc(C)n1.
What is the InChIKey of 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine?
The InChIKey is AIMRYPJEFMDPGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2S/c1-3-11-17-15(10-9-14-7-5-12-19-14)16-8-4-6-13(2)18-16/h4-8,12,15,17H,3,9-11H2,1-2H3.
What are the key properties of 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine?
1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine has a molecular weight of 274.43 g/mol, XLogP of 4.13, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methyl-2-pyridinyl)-N-propyl-3-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 63773530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).