N-(1-thiophen-2-ylethyl)formamide

C7H9NOS — CID 18681499

IUPACN-(1-thiophen-2-ylethyl)formamide
SMILESCC(NC=O)c1cccs1
InChIInChI=1S/C7H9NOS/c1-6(8-5-9)7-3-2-4-10-7/h2-6H,1H3,(H,8,9)
InChIKeyGYFGSYZDTMHJSS-UHFFFAOYSA-N
MW155.22 g/mol
LogP1.56
Rot. Bonds3

About N-(1-thiophen-2-ylethyl)formamide

N-(1-thiophen-2-ylethyl)formamide (PubChem CID 18681499) has the molecular formula C7H9NOS and a molecular weight of 155.22 g/mol. Its IUPAC name is N-(1-thiophen-2-ylethyl)formamide.

Molecular Properties

Compound NameN-(1-thiophen-2-ylethyl)formamide
PubChem CID18681499
Molecular FormulaC7H9NOS
Molecular Weight155.22 g/mol
Exact Mass155.04
IUPAC NameN-(1-thiophen-2-ylethyl)formamide
SMILESCC(NC=O)c1cccs1
InChIInChI=1S/C7H9NOS/c1-6(8-5-9)7-3-2-4-10-7/h2-6H,1H3,(H,8,9)
InChIKeyGYFGSYZDTMHJSS-UHFFFAOYSA-N
XLogP1.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.22
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-2-ylethyl)formamide?
The IUPAC name of N-(1-thiophen-2-ylethyl)formamide (CID 18681499) is N-(1-thiophen-2-ylethyl)formamide.
What is the SMILES notation for N-(1-thiophen-2-ylethyl)formamide?
The canonical SMILES for N-(1-thiophen-2-ylethyl)formamide is CC(NC=O)c1cccs1.
What is the InChIKey of N-(1-thiophen-2-ylethyl)formamide?
The InChIKey is GYFGSYZDTMHJSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NOS/c1-6(8-5-9)7-3-2-4-10-7/h2-6H,1H3,(H,8,9).
What are the key properties of N-(1-thiophen-2-ylethyl)formamide?
N-(1-thiophen-2-ylethyl)formamide has a molecular weight of 155.22 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-2-ylethyl)formamide is sourced from PubChem (CID 18681499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).