2-[propyl(thiophen-2-ylmethyl)amino]acetamide

C10H16N2OS — CID 163847737

IUPAC2-[propyl(thiophen-2-ylmethyl)amino]acetamide
SMILESCCCN(CC(N)=O)Cc1cccs1
InChIInChI=1S/C10H16N2OS/c1-2-5-12(8-10(11)13)7-9-4-3-6-14-9/h3-4,6H,2,5,7-8H2,1H3,(H2,11,13)
InChIKeyORQHLAPZOHUQOB-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.45
Rot. Bonds6

About 2-[propyl(thiophen-2-ylmethyl)amino]acetamide

2-[propyl(thiophen-2-ylmethyl)amino]acetamide (PubChem CID 163847737) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 2-[propyl(thiophen-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound Name2-[propyl(thiophen-2-ylmethyl)amino]acetamide
PubChem CID163847737
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name2-[propyl(thiophen-2-ylmethyl)amino]acetamide
SMILESCCCN(CC(N)=O)Cc1cccs1
InChIInChI=1S/C10H16N2OS/c1-2-5-12(8-10(11)13)7-9-4-3-6-14-9/h3-4,6H,2,5,7-8H2,1H3,(H2,11,13)
InChIKeyORQHLAPZOHUQOB-UHFFFAOYSA-N
XLogP1.45
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[propyl(thiophen-2-ylmethyl)amino]acetamide?
The IUPAC name of 2-[propyl(thiophen-2-ylmethyl)amino]acetamide (CID 163847737) is 2-[propyl(thiophen-2-ylmethyl)amino]acetamide.
What is the SMILES notation for 2-[propyl(thiophen-2-ylmethyl)amino]acetamide?
The canonical SMILES for 2-[propyl(thiophen-2-ylmethyl)amino]acetamide is CCCN(CC(N)=O)Cc1cccs1.
What is the InChIKey of 2-[propyl(thiophen-2-ylmethyl)amino]acetamide?
The InChIKey is ORQHLAPZOHUQOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-2-5-12(8-10(11)13)7-9-4-3-6-14-9/h3-4,6H,2,5,7-8H2,1H3,(H2,11,13).
What are the key properties of 2-[propyl(thiophen-2-ylmethyl)amino]acetamide?
2-[propyl(thiophen-2-ylmethyl)amino]acetamide has a molecular weight of 212.32 g/mol, XLogP of 1.45, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[propyl(thiophen-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 163847737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).