N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide

C11H15FN2OS — CID 45208476

IUPACN-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide
SMILESO=C(NCCF)c1ccc(C2CCCN2)s1
InChIInChI=1S/C11H15FN2OS/c12-5-7-14-11(15)10-4-3-9(16-10)8-2-1-6-13-8/h3-4,8,13H,1-2,5-7H2,(H,14,15)
InChIKeyBAFAHBQGSWRWLA-UHFFFAOYSA-N
MW242.32 g/mol
LogP1.87
Rot. Bonds4

About N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide

N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide (PubChem CID 45208476) has the molecular formula C11H15FN2OS and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide
PubChem CID45208476
Molecular FormulaC11H15FN2OS
Molecular Weight242.32 g/mol
Exact Mass242.09
IUPAC NameN-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide
SMILESO=C(NCCF)c1ccc(C2CCCN2)s1
InChIInChI=1S/C11H15FN2OS/c12-5-7-14-11(15)10-4-3-9(16-10)8-2-1-6-13-8/h3-4,8,13H,1-2,5-7H2,(H,14,15)
InChIKeyBAFAHBQGSWRWLA-UHFFFAOYSA-N
XLogP1.87
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenylethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide
CID 45178110
methyl 5-pyrrolidin-2-ylthiophene-2-carboxylate
CID 130001149
N-[[1-(dimethylamino)cyclohexyl]methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 154924430
N-(6-oxo-1H-pyridin-3-yl)-5-pyrrolidin-2-ylthiophene-2-carboxamide
CID 166305537
N-pyridin-2-yl-5-pyrrolidin-2-ylthiophene-2-carboxamide
CID 45236193
N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide
CID 45206060
5-[(2S)-pyrrolidin-2-yl]-N-(1,2,4-triazin-3-yl)thiophene-2-carboxamide
CID 31017599
N-(2-chloro-3-pyridinyl)-5-[(2R)-pyrrolidin-2-yl]thiophene-2-carboxamide
CID 31223583
N,N,4-trimethyl-2-[[5-[(2S)-pyrrolidin-2-yl]thiophene-2-carbonyl]amino]-1,3-thiazole-5-carboxamide
CID 31044771
N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide
CID 45185745
N-[2-oxo-2-(quinolin-8-ylamino)ethyl]-5-pyrrolidin-2-ylthiophene-2-carboxamide;2,2,2-trifluoroacetic acid
CID 166261329
N-(2-fluoroethyl)-5-methylthiophene-2-carboxamide
CID 130710625

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide?
The IUPAC name of N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide (CID 45208476) is N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide.
What is the SMILES notation for N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide?
The canonical SMILES for N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide is O=C(NCCF)c1ccc(C2CCCN2)s1.
What is the InChIKey of N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide?
The InChIKey is BAFAHBQGSWRWLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2OS/c12-5-7-14-11(15)10-4-3-9(16-10)8-2-1-6-13-8/h3-4,8,13H,1-2,5-7H2,(H,14,15).
What are the key properties of N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide?
N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide has a molecular weight of 242.32 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-5-pyrrolidin-2-ylthiophene-2-carboxamide is sourced from PubChem (CID 45208476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).