3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide

C15H17NO2S — CID 31110060

IUPAC3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide
SMILESCOCc1cccc(C(=O)N[C@H](C)c2cccs2)c1
InChIInChI=1S/C15H17NO2S/c1-11(14-7-4-8-19-14)16-15(17)13-6-3-5-12(9-13)10-18-2/h3-9,11H,10H2,1-2H3,(H,16,17)/t11-/m1/s1
InChIKeyYXCHCTLUBDOGSG-LLVKDONJSA-N
MW275.37 g/mol
LogP3.39
Rot. Bonds5

About 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide

3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide (PubChem CID 31110060) has the molecular formula C15H17NO2S and a molecular weight of 275.37 g/mol. Its IUPAC name is 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide.

Molecular Properties

Compound Name3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide
PubChem CID31110060
Molecular FormulaC15H17NO2S
Molecular Weight275.37 g/mol
Exact Mass275.10
IUPAC Name3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide
SMILESCOCc1cccc(C(=O)N[C@H](C)c2cccs2)c1
InChIInChI=1S/C15H17NO2S/c1-11(14-7-4-8-19-14)16-15(17)13-6-3-5-12(9-13)10-18-2/h3-9,11H,10H2,1-2H3,(H,16,17)/t11-/m1/s1
InChIKeyYXCHCTLUBDOGSG-LLVKDONJSA-N
XLogP3.39
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(chloromethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 81408549
3-methoxy-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 7918037
3-[[(1R)-1-thiophen-2-ylethyl]carbamoyl]benzoic acid
CID 51704015
3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 7918060
3-fluoro-N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 7742328
2-[[3-(methoxymethyl)benzoyl]amino]propanoic acid
CID 43170851
N-(1-amino-1-oxopropan-2-yl)-3-(methoxymethyl)benzamide
CID 134045690
N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 768439
(2S,3R)-3-hydroxy-2-[[3-(methoxymethyl)benzoyl]amino]butanoic acid
CID 104964995
N-[(2R)-butan-2-yl]-3-[[[(1R)-1-thiophen-2-ylethyl]amino]methyl]benzamide
CID 97230259
(2S)-2-[[3-(methoxymethyl)benzoyl]amino]-3-methylpentanoic acid
CID 61172026
N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide
CID 134053714

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide?
The IUPAC name of 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide (CID 31110060) is 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide.
What is the SMILES notation for 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide?
The canonical SMILES for 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide is COCc1cccc(C(=O)N[C@H](C)c2cccs2)c1.
What is the InChIKey of 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide?
The InChIKey is YXCHCTLUBDOGSG-LLVKDONJSA-N. The full InChI is InChI=1S/C15H17NO2S/c1-11(14-7-4-8-19-14)16-15(17)13-6-3-5-12(9-13)10-18-2/h3-9,11H,10H2,1-2H3,(H,16,17)/t11-/m1/s1.
What are the key properties of 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide?
3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide has a molecular weight of 275.37 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide is sourced from PubChem (CID 31110060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).