2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide

C14H15FN2OS — CID 63248048

IUPAC2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide
SMILESCCNc1c(F)cccc1C(=O)NCc1ccsc1
InChIInChI=1S/C14H15FN2OS/c1-2-16-13-11(4-3-5-12(13)15)14(18)17-8-10-6-7-19-9-10/h3-7,9,16H,2,8H2,1H3,(H,17,18)
InChIKeyVZFXSRZYPRBOJG-UHFFFAOYSA-N
MW278.35 g/mol
LogP3.25
Rot. Bonds5

About 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide

2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide (PubChem CID 63248048) has the molecular formula C14H15FN2OS and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide
PubChem CID63248048
Molecular FormulaC14H15FN2OS
Molecular Weight278.35 g/mol
Exact Mass278.09
IUPAC Name2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide
SMILESCCNc1c(F)cccc1C(=O)NCc1ccsc1
InChIInChI=1S/C14H15FN2OS/c1-2-16-13-11(4-3-5-12(13)15)14(18)17-8-10-6-7-19-9-10/h3-7,9,16H,2,8H2,1H3,(H,17,18)
InChIKeyVZFXSRZYPRBOJG-UHFFFAOYSA-N
XLogP3.25
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(ethylamino)-3-fluoro-N-(pyridin-4-ylmethyl)benzamide
CID 62649385
N-[(4-bromophenyl)methyl]-2-(ethylamino)-3-fluorobenzamide
CID 62649718
N-ethyl-2-(ethylamino)-3-fluorobenzamide
CID 62648907
2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 63247950
3-bromo-2-fluoro-N-(thiophen-3-ylmethyl)benzamide
CID 106544257
2-(ethylamino)-3-fluoro-N-(2-phenylethyl)benzamide
CID 62648927
2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide
CID 55100188
2-(ethylamino)-3-fluoro-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 62660746
2-fluoro-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 107358701
3-fluoro-2-(propylamino)-N-(pyridin-4-ylmethyl)benzamide
CID 62649386
2-(ethylamino)-N-[2-(ethylsulfamoyl)ethyl]-3-fluorobenzamide
CID 106342576
N-benzyl-3-fluoro-2-(methylamino)benzamide
CID 55100092

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide?
The IUPAC name of 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide (CID 63248048) is 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide.
What is the SMILES notation for 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide?
The canonical SMILES for 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide is CCNc1c(F)cccc1C(=O)NCc1ccsc1.
What is the InChIKey of 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide?
The InChIKey is VZFXSRZYPRBOJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2OS/c1-2-16-13-11(4-3-5-12(13)15)14(18)17-8-10-6-7-19-9-10/h3-7,9,16H,2,8H2,1H3,(H,17,18).
What are the key properties of 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide?
2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide has a molecular weight of 278.35 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide is sourced from PubChem (CID 63248048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).