N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide

C15H16FNOS — CID 71059174

IUPACN,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide
SMILESCCN(CC)C(=O)c1ccsc1-c1ccc(F)cc1
InChIInChI=1S/C15H16FNOS/c1-3-17(4-2)15(18)13-9-10-19-14(13)11-5-7-12(16)8-6-11/h5-10H,3-4H2,1-2H3
InChIKeyUQRHFHLQCUVGPK-UHFFFAOYSA-N
MW277.36 g/mol
LogP4.04
Rot. Bonds4

About N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide

N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide (PubChem CID 71059174) has the molecular formula C15H16FNOS and a molecular weight of 277.36 g/mol. Its IUPAC name is N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide
PubChem CID71059174
Molecular FormulaC15H16FNOS
Molecular Weight277.36 g/mol
Exact Mass277.09
IUPAC NameN,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide
SMILESCCN(CC)C(=O)c1ccsc1-c1ccc(F)cc1
InChIInChI=1S/C15H16FNOS/c1-3-17(4-2)15(18)13-9-10-19-14(13)11-5-7-12(16)8-6-11/h5-10H,3-4H2,1-2H3
InChIKeyUQRHFHLQCUVGPK-UHFFFAOYSA-N
XLogP4.04
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Thiophene derivative, 3d
CID 15984018
Thiophene derivative, 3b
CID 25023796
Thiophene derivative, 3c
CID 25023797
Thiophene derivative, 3e
CID 25023798
1-(5-{[Benzyl(methyl)amino]methyl}thiophen-2-yl)-2,2,2-trifluoroethan-1-one
CID 25023811
N-benzyl-N-methyl-4-(2,2,2-trifluoroacetyl)thiophene-2-carboxamide
CID 25023816
3-methyl-N-[(4-methylphenyl)methyl]thiophene-2-carboxamide
CID 841341
5-methyl-N-(4-methylbenzyl)-2-thiophenecarboxamide
CID 1224525
N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide
CID 2255653
Phenyl-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
CID 2740735
N-(2-Phenylethyl)-2-thiophenecarboxamide
CID 728650
4-methyl-N-[2-(2-thienyl)ethyl]benzamide
CID 1511023

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide?
The IUPAC name of N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide (CID 71059174) is N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide.
What is the SMILES notation for N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide?
The canonical SMILES for N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide is CCN(CC)C(=O)c1ccsc1-c1ccc(F)cc1.
What is the InChIKey of N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide?
The InChIKey is UQRHFHLQCUVGPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNOS/c1-3-17(4-2)15(18)13-9-10-19-14(13)11-5-7-12(16)8-6-11/h5-10H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide?
N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide has a molecular weight of 277.36 g/mol, XLogP of 4.04, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(4-fluorophenyl)thiophene-3-carboxamide is sourced from PubChem (CID 71059174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).