4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide

C7H9FN2OS — CID 130922992

IUPAC4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide
SMILESNc1csc(C(=O)NCCF)c1
InChIInChI=1S/C7H9FN2OS/c8-1-2-10-7(11)6-3-5(9)4-12-6/h3-4H,1-2,9H2,(H,10,11)
InChIKeyBCCCFAWFQIZXOT-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.03
Rot. Bonds3

About 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide

4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide (PubChem CID 130922992) has the molecular formula C7H9FN2OS and a molecular weight of 188.23 g/mol. Its IUPAC name is 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide
PubChem CID130922992
Molecular FormulaC7H9FN2OS
Molecular Weight188.23 g/mol
Exact Mass188.04
IUPAC Name4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide
SMILESNc1csc(C(=O)NCCF)c1
InChIInChI=1S/C7H9FN2OS/c8-1-2-10-7(11)6-3-5(9)4-12-6/h3-4H,1-2,9H2,(H,10,11)
InChIKeyBCCCFAWFQIZXOT-UHFFFAOYSA-N
XLogP1.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide?
The IUPAC name of 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide (CID 130922992) is 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide?
The canonical SMILES for 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide is Nc1csc(C(=O)NCCF)c1.
What is the InChIKey of 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide?
The InChIKey is BCCCFAWFQIZXOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2OS/c8-1-2-10-7(11)6-3-5(9)4-12-6/h3-4H,1-2,9H2,(H,10,11).
What are the key properties of 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide?
4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide has a molecular weight of 188.23 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide is sourced from PubChem (CID 130922992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).