N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide

C15H15FN2OS — CID 110361789

IUPACN-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide
SMILESO=C(Nc1cc(N2CCCC2)ccc1F)c1cccs1
InChIInChI=1S/C15H15FN2OS/c16-12-6-5-11(18-7-1-2-8-18)10-13(12)17-15(19)14-4-3-9-20-14/h3-6,9-10H,1-2,7-8H2,(H,17,19)
InChIKeyRUHJEPUAGCYOJE-UHFFFAOYSA-N
MW290.36 g/mol
LogP3.74
Rot. Bonds3

About N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide

N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide (PubChem CID 110361789) has the molecular formula C15H15FN2OS and a molecular weight of 290.36 g/mol. Its IUPAC name is N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide
PubChem CID110361789
Molecular FormulaC15H15FN2OS
Molecular Weight290.36 g/mol
Exact Mass290.09
IUPAC NameN-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide
SMILESO=C(Nc1cc(N2CCCC2)ccc1F)c1cccs1
InChIInChI=1S/C15H15FN2OS/c16-12-6-5-11(18-7-1-2-8-18)10-13(12)17-15(19)14-4-3-9-20-14/h3-6,9-10H,1-2,7-8H2,(H,17,19)
InChIKeyRUHJEPUAGCYOJE-UHFFFAOYSA-N
XLogP3.74
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4,5-trifluorophenyl)thiophene-2-carboxamide
CID 63372873
N-(2-fluoro-5-piperidin-1-ylphenyl)furan-2-carboxamide
CID 110362234
N-[3-[(2-methyl-4-pyrrolidin-1-ylphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
CID 46563897
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
CID 110361821
N-(2-fluoro-5-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 110362254
N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]thiophene-2-carboxamide
CID 953308
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-2-methylpropanamide
CID 110361779
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)cyclohexanecarboxamide
CID 110361783
N-(2-fluoro-5-piperidin-1-ylphenyl)propanamide
CID 110362225
N-[5-chloro-2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 51147954
N-(5-fluoro-1,3-dimethyl-2,2-dioxo-2λ6,1,3-benzothiadiazol-6-yl)thiophene-2-carboxamide
CID 122244007
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide
CID 110361803

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide (CID 110361789) is N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide is O=C(Nc1cc(N2CCCC2)ccc1F)c1cccs1.
What is the InChIKey of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide?
The InChIKey is RUHJEPUAGCYOJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2OS/c16-12-6-5-11(18-7-1-2-8-18)10-13(12)17-15(19)14-4-3-9-20-14/h3-6,9-10H,1-2,7-8H2,(H,17,19).
What are the key properties of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide?
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 110361789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).