N-(thiophen-2-ylmethyl)acetamide

C7H9NOS — CID 30617

IUPACN-(thiophen-2-ylmethyl)acetamide
SMILESCC(=O)NCc1cccs1
InChIInChI=1S/C7H9NOS/c1-6(9)8-5-7-3-2-4-10-7/h2-4H,5H2,1H3,(H,8,9)
InChIKeyBQRIKSCISYLMQV-UHFFFAOYSA-N
MW155.22 g/mol
LogP1.38
Rot. Bonds2

About N-(thiophen-2-ylmethyl)acetamide

N-(thiophen-2-ylmethyl)acetamide (PubChem CID 30617) has the molecular formula C7H9NOS and a molecular weight of 155.22 g/mol. Its IUPAC name is N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(thiophen-2-ylmethyl)acetamide
PubChem CID30617
Molecular FormulaC7H9NOS
Molecular Weight155.22 g/mol
Exact Mass155.04
IUPAC NameN-(thiophen-2-ylmethyl)acetamide
SMILESCC(=O)NCc1cccs1
InChIInChI=1S/C7H9NOS/c1-6(9)8-5-7-3-2-4-10-7/h2-4H,5H2,1H3,(H,8,9)
InChIKeyBQRIKSCISYLMQV-UHFFFAOYSA-N
XLogP1.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.22
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of N-(thiophen-2-ylmethyl)acetamide (CID 30617) is N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for N-(thiophen-2-ylmethyl)acetamide is CC(=O)NCc1cccs1.
What is the InChIKey of N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is BQRIKSCISYLMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NOS/c1-6(9)8-5-7-3-2-4-10-7/h2-4H,5H2,1H3,(H,8,9).
What are the key properties of N-(thiophen-2-ylmethyl)acetamide?
N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 155.22 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 30617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).