N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide

C15H16FNO2S — CID 71810601

IUPACN-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide
SMILESCOC(C)(CNC(=O)c1ccsc1)c1ccccc1F
InChIInChI=1S/C15H16FNO2S/c1-15(19-2,12-5-3-4-6-13(12)16)10-17-14(18)11-7-8-20-9-11/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyUOUOGOMPGCZUOC-UHFFFAOYSA-N
MW293.36 g/mol
LogP3.18
Rot. Bonds5

About N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide

N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide (PubChem CID 71810601) has the molecular formula C15H16FNO2S and a molecular weight of 293.36 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide
PubChem CID71810601
Molecular FormulaC15H16FNO2S
Molecular Weight293.36 g/mol
Exact Mass293.09
IUPAC NameN-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide
SMILESCOC(C)(CNC(=O)c1ccsc1)c1ccccc1F
InChIInChI=1S/C15H16FNO2S/c1-15(19-2,12-5-3-4-6-13(12)16)10-17-14(18)11-7-8-20-9-11/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyUOUOGOMPGCZUOC-UHFFFAOYSA-N
XLogP3.18
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-2-phenylethyl)-2-thiophenecarboxamide
CID 2812766
2-Oxo-2-[(thiophen-2-ylmethyl)amino]ethyl 2-methylbenzoate
CID 2480348
[2-Oxo-2-(thiophen-2-ylmethylamino)ethyl] 2,6-difluorobenzoate
CID 2481084
[1-(4-Fluorophenyl)-2-(2-methoxyethylamino)-2-oxoethyl] thiophene-2-carboxylate
CID 3220334
2-(Benzylamino)-2-oxoethyl 3-methylthiophene-2-carboxylate
CID 3266695
[2-[2-(4-Fluorophenyl)ethylamino]-2-oxoethyl] thiophene-2-carboxylate
CID 8630918
Benzyl 2-[(3-methylthiophene-2-carbonyl)amino]acetate
CID 24819879
2-(Benzylamino)-2-oxoethyl thiophene-2-carboxylate
CID 2355161
[2-Oxo-2-(thiophen-2-ylmethylamino)ethyl] 3,5-dimethylbenzoate
CID 2481081
(4-Fluorophenyl)methyl 2-[2-(thiophen-2-ylformamido)acetamido]acetate
CID 3158551
1-(Benzylcarbamoyl)-2-methylpropyl thiophene-2-carboxylate
CID 3220264
Thiophene-2-carboxylic acid 1-(4-fluoro-benzylcarbamoyl)-2-methyl-propyl ester
CID 3220265

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide (CID 71810601) is N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide is COC(C)(CNC(=O)c1ccsc1)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide?
The InChIKey is UOUOGOMPGCZUOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2S/c1-15(19-2,12-5-3-4-6-13(12)16)10-17-14(18)11-7-8-20-9-11/h3-9H,10H2,1-2H3,(H,17,18).
What are the key properties of N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide?
N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide has a molecular weight of 293.36 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-3-carboxamide is sourced from PubChem (CID 71810601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).