N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide

C15H24N2O2S — CID 66386410

IUPACN-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide
SMILESCC(=O)Nc1ccsc1CNCCOC1CCCCC1
InChIInChI=1S/C15H24N2O2S/c1-12(18)17-14-7-10-20-15(14)11-16-8-9-19-13-5-3-2-4-6-13/h7,10,13,16H,2-6,8-9,11H2,1H3,(H,17,18)
InChIKeyYSQAPUAIFNRMFC-UHFFFAOYSA-N
MW296.44 g/mol
LogP3.15
Rot. Bonds7

About N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide

N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide (PubChem CID 66386410) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide.

Molecular Properties

Compound NameN-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide
PubChem CID66386410
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC NameN-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide
SMILESCC(=O)Nc1ccsc1CNCCOC1CCCCC1
InChIInChI=1S/C15H24N2O2S/c1-12(18)17-14-7-10-20-15(14)11-16-8-9-19-13-5-3-2-4-6-13/h7,10,13,16H,2-6,8-9,11H2,1H3,(H,17,18)
InChIKeyYSQAPUAIFNRMFC-UHFFFAOYSA-N
XLogP3.15
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-cyclobutyloxy-N-[(3-methylthiophen-2-yl)methyl]ethanamine
CID 62584380
N-[2-[(cyclopropylmethylamino)methyl]thiophen-3-yl]acetamide
CID 66384880
N-[2-[[2-(2-methylprop-2-enoxy)ethylamino]methyl]thiophen-3-yl]acetamide
CID 114465669
N-[2-[[3-(2-methylpropoxy)propylamino]methyl]thiophen-3-yl]acetamide
CID 66385918
N-[2-[(thian-2-ylmethylamino)methyl]thiophen-3-yl]acetamide
CID 80595252
N-[2-[[2-(3-methylcyclohexyl)ethylamino]methyl]thiophen-3-yl]acetamide
CID 66384800
N-[2-[[(2-methylcycloheptyl)amino]methyl]thiophen-3-yl]acetamide
CID 66386018
2-(3-methylcyclohexyl)oxy-N-[(3-methylthiophen-2-yl)methyl]ethanamine
CID 62598139
N-[2-[[(4-aminocyclohexyl)amino]methyl]thiophen-3-yl]acetamide
CID 66386996
N-[2-[[2-(methylsulfamoyl)ethylamino]methyl]thiophen-3-yl]acetamide
CID 114174810
N-[2-[[(2-methoxycyclopentyl)amino]methyl]thiophen-3-yl]acetamide
CID 66385192
N-[2-[[(1-cyclopropylpiperidin-4-yl)amino]methyl]thiophen-3-yl]acetamide
CID 66387368

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide?
The IUPAC name of N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide (CID 66386410) is N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide.
What is the SMILES notation for N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide?
The canonical SMILES for N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide is CC(=O)Nc1ccsc1CNCCOC1CCCCC1.
What is the InChIKey of N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide?
The InChIKey is YSQAPUAIFNRMFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-12(18)17-14-7-10-20-15(14)11-16-8-9-19-13-5-3-2-4-6-13/h7,10,13,16H,2-6,8-9,11H2,1H3,(H,17,18).
What are the key properties of N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide?
N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide has a molecular weight of 296.44 g/mol, XLogP of 3.15, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide is sourced from PubChem (CID 66386410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).