2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine

C14H24N2S — CID 62089125

IUPAC2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine
SMILESCC(NCC(C)N1CCCCC1)c1ccsc1
InChIInChI=1S/C14H24N2S/c1-12(16-7-4-3-5-8-16)10-15-13(2)14-6-9-17-11-14/h6,9,11-13,15H,3-5,7-8,10H2,1-2H3
InChIKeyNGQJCCLOJHYOOC-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.27
Rot. Bonds5

About 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine

2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine (PubChem CID 62089125) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine.

Molecular Properties

Compound Name2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine
PubChem CID62089125
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine
SMILESCC(NCC(C)N1CCCCC1)c1ccsc1
InChIInChI=1S/C14H24N2S/c1-12(16-7-4-3-5-8-16)10-15-13(2)14-6-9-17-11-14/h6,9,11-13,15H,3-5,7-8,10H2,1-2H3
InChIKeyNGQJCCLOJHYOOC-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-pyrrolidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine
CID 62091363
2-piperidin-1-yl-N-[1-(1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 115879085
2-methylsulfanyl-N-(1-thiophen-3-ylethyl)propan-1-amine
CID 115895627
1-cyclopropyl-2-(1-thiophen-3-ylethylamino)ethanol
CID 63295027
N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-N'-propan-2-yloxamide
CID 16932587
1-thiophen-3-yl-N-(1-thiophen-3-ylethyl)ethanamine
CID 14249916
N-[(1-methylpiperidin-3-yl)methyl]-1-thiophen-3-ylethanamine
CID 62090707
1-[(1-thiophen-3-ylethylamino)methyl]cyclohexan-1-ol
CID 62840169
2-methyl-N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)propanamide
CID 16931597
2,2-dimethyl-N-(1-thiophen-3-ylethyl)propan-1-amine
CID 62090002
N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)propanamide
CID 16931322
1-cyclopentyloxy-3-(1-thiophen-3-ylethylamino)propan-2-ol
CID 62840331

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine?
The IUPAC name of 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine (CID 62089125) is 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine.
What is the SMILES notation for 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine?
The canonical SMILES for 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine is CC(NCC(C)N1CCCCC1)c1ccsc1.
What is the InChIKey of 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine?
The InChIKey is NGQJCCLOJHYOOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-12(16-7-4-3-5-8-16)10-15-13(2)14-6-9-17-11-14/h6,9,11-13,15H,3-5,7-8,10H2,1-2H3.
What are the key properties of 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine?
2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine has a molecular weight of 252.43 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-1-yl-N-(1-thiophen-3-ylethyl)propan-1-amine is sourced from PubChem (CID 62089125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).