N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide

C16H16FNO2S — CID 7243546

IUPACN-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide
SMILESO=C(Nc1ccccc1F)C1(c2cccs2)CCOCC1
InChIInChI=1S/C16H16FNO2S/c17-12-4-1-2-5-13(12)18-15(19)16(7-9-20-10-8-16)14-6-3-11-21-14/h1-6,11H,7-10H2,(H,18,19)
InChIKeyAQOXDDKYDYQGMF-UHFFFAOYSA-N
MW305.37 g/mol
LogP3.57
Rot. Bonds3

About N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide

N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide (PubChem CID 7243546) has the molecular formula C16H16FNO2S and a molecular weight of 305.37 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide
PubChem CID7243546
Molecular FormulaC16H16FNO2S
Molecular Weight305.37 g/mol
Exact Mass305.09
IUPAC NameN-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide
SMILESO=C(Nc1ccccc1F)C1(c2cccs2)CCOCC1
InChIInChI=1S/C16H16FNO2S/c17-12-4-1-2-5-13(12)18-15(19)16(7-9-20-10-8-16)14-6-3-11-21-14/h1-6,11H,7-10H2,(H,18,19)
InChIKeyAQOXDDKYDYQGMF-UHFFFAOYSA-N
XLogP3.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.37
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435427
N-benzhydryl-4-thiophen-2-yloxane-4-carboxamide
CID 7243574
N-(2,4-difluorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435435
N-(4-methyl-1,3-thiazol-2-yl)-4-thiophen-2-yloxane-4-carboxamide
CID 7243534
N-(6-methyl-2-pyridinyl)-4-thiophen-2-yloxane-4-carboxamide
CID 12005993
N-(2-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435589
N-(3-nitrophenyl)-4-thiophen-2-yloxane-4-carboxamide
CID 7243583
N-(2-methoxyphenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435562
N-(2-morpholin-4-ium-4-ylethyl)-4-thiophen-2-yloxane-4-carboxamide
CID 7243535
N-[(4-phenylsulfanyloxan-4-yl)methyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 90523284
N-pyrimidin-2-yl-1-thiophen-2-ylcyclopropane-1-carboxamide
CID 110698477
N-[2-(1H-indol-3-yl)ethyl]-4-thiophen-2-yloxane-4-carboxamide
CID 7217402

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide (CID 7243546) is N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide is O=C(Nc1ccccc1F)C1(c2cccs2)CCOCC1.
What is the InChIKey of N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide?
The InChIKey is AQOXDDKYDYQGMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2S/c17-12-4-1-2-5-13(12)18-15(19)16(7-9-20-10-8-16)14-6-3-11-21-14/h1-6,11H,7-10H2,(H,18,19).
What are the key properties of N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide?
N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide has a molecular weight of 305.37 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-4-thiophen-2-yloxane-4-carboxamide is sourced from PubChem (CID 7243546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).