N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide

C15H16FNOS — CID 79770274

IUPACN-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide
SMILESCCN(Cc1cccs1)C(=O)c1ccc(C)cc1F
InChIInChI=1S/C15H16FNOS/c1-3-17(10-12-5-4-8-19-12)15(18)13-7-6-11(2)9-14(13)16/h4-9H,3,10H2,1-2H3
InChIKeyVTRZCBIYRHSWHY-UHFFFAOYSA-N
MW277.36 g/mol
LogP3.86
Rot. Bonds4

About N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide

N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 79770274) has the molecular formula C15H16FNOS and a molecular weight of 277.36 g/mol. Its IUPAC name is N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide
PubChem CID79770274
Molecular FormulaC15H16FNOS
Molecular Weight277.36 g/mol
Exact Mass277.09
IUPAC NameN-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide
SMILESCCN(Cc1cccs1)C(=O)c1ccc(C)cc1F
InChIInChI=1S/C15H16FNOS/c1-3-17(10-12-5-4-8-19-12)15(18)13-7-6-11(2)9-14(13)16/h4-9H,3,10H2,1-2H3
InChIKeyVTRZCBIYRHSWHY-UHFFFAOYSA-N
XLogP3.86
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 ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-hydroxy-5-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 60655389
N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 134014370
2-amino-N-ethyl-3-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 62660536
4-chloro-N-ethyl-2-hydroxy-N-(thiophen-2-ylmethyl)benzamide
CID 60655635
N-ethyl-2,4-dihydroxy-N-(thiophen-2-ylmethyl)benzamide
CID 103602482
N-ethyl-2-fluoro-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 107358620
N-ethyl-2-fluoro-4-methyl-N-propylbenzamide
CID 79779356
N-ethyl-4-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 60655445
2-chloro-N-ethyl-N-(thiophen-2-ylmethyl)furan-3-carboxamide
CID 106686239
2-chloro-N-ethyl-5-sulfanyl-N-(thiophen-2-ylmethyl)benzamide
CID 107024588
4-chloro-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 78801917
N-ethyl-6-(4-fluorophenyl)-3-methyl-N-(thiophen-2-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134036791

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide (CID 79770274) is N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide is CCN(Cc1cccs1)C(=O)c1ccc(C)cc1F.
What is the InChIKey of N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is VTRZCBIYRHSWHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNOS/c1-3-17(10-12-5-4-8-19-12)15(18)13-7-6-11(2)9-14(13)16/h4-9H,3,10H2,1-2H3.
What are the key properties of N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide?
N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 277.36 g/mol, XLogP of 3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 79770274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).