N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide

C7H7FN2O2S — CID 123351083

IUPACN-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide
SMILESNC(=O)CNC(=O)c1ccsc1F
InChIInChI=1S/C7H7FN2O2S/c8-6-4(1-2-13-6)7(12)10-3-5(9)11/h1-2H,3H2,(H2,9,11)(H,10,12)
InChIKeyPZAZNXTVSWYEBD-UHFFFAOYSA-N
MW202.21 g/mol
LogP0.10
Rot. Bonds3

About N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide

N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide (PubChem CID 123351083) has the molecular formula C7H7FN2O2S and a molecular weight of 202.21 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide
PubChem CID123351083
Molecular FormulaC7H7FN2O2S
Molecular Weight202.21 g/mol
Exact Mass202.02
IUPAC NameN-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide
SMILESNC(=O)CNC(=O)c1ccsc1F
InChIInChI=1S/C7H7FN2O2S/c8-6-4(1-2-13-6)7(12)10-3-5(9)11/h1-2H,3H2,(H2,9,11)(H,10,12)
InChIKeyPZAZNXTVSWYEBD-UHFFFAOYSA-N
XLogP0.10
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(prop-2-en-1-yl)-N'-[(thiophen-3-yl)methyl]ethanediamide
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N-Butylthiophene-3-carboxamide
CID 12161492
3-thiophenecarboxamide, N-2-propynyl-
CID 60656784
N-[2-oxo-2-(propylamino)ethyl]thiophene-3-carboxamide
CID 45850141
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]thiophene-3-carboxamide
CID 47017211
N-[(3S)-2-oxoazepan-3-yl]thiophene-3-carboxamide
CID 93615200
2-[N-methyl-1-(thiophen-3-yl)formamido]-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 53620006
N-(2,2,2-trifluoroethyl)thiophene-3-carboxamide
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2-fluoro-N-[2-(methylamino)-2-oxoethyl]thiophene-3-carboxamide
CID 89833690

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide (CID 123351083) is N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide is NC(=O)CNC(=O)c1ccsc1F.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide?
The InChIKey is PZAZNXTVSWYEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2O2S/c8-6-4(1-2-13-6)7(12)10-3-5(9)11/h1-2H,3H2,(H2,9,11)(H,10,12).
What are the key properties of N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide?
N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide has a molecular weight of 202.21 g/mol, XLogP of 0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-fluorothiophene-3-carboxamide is sourced from PubChem (CID 123351083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).