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

C14H15NOS — CID 7918060

IUPAC3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide
SMILESCc1cccc(C(=O)N[C@H](C)c2cccs2)c1
InChIInChI=1S/C14H15NOS/c1-10-5-3-6-12(9-10)14(16)15-11(2)13-7-4-8-17-13/h3-9,11H,1-2H3,(H,15,16)/t11-/m1/s1
InChIKeyZOBJYYNGTKDERJ-LLVKDONJSA-N
MW245.35 g/mol
LogP3.55
Rot. Bonds3

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

3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide (PubChem CID 7918060) has the molecular formula C14H15NOS and a molecular weight of 245.35 g/mol. Its IUPAC name is 3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide.

Molecular Properties

Compound Name3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide
PubChem CID7918060
Molecular FormulaC14H15NOS
Molecular Weight245.35 g/mol
Exact Mass245.09
IUPAC Name3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide
SMILESCc1cccc(C(=O)N[C@H](C)c2cccs2)c1
InChIInChI=1S/C14H15NOS/c1-10-5-3-6-12(9-10)14(16)15-11(2)13-7-4-8-17-13/h3-9,11H,1-2H3,(H,15,16)/t11-/m1/s1
InChIKeyZOBJYYNGTKDERJ-LLVKDONJSA-N
XLogP3.55
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-[(1S)-2-methyl-1-thiophen-2-ylpropyl]benzamide
CID 9051719
3-[[(1R)-1-thiophen-2-ylethyl]carbamoyl]benzoic acid
CID 51704015
3-fluoro-N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 7742328
2-[(3-methylbenzoyl)amino]-2-thiophen-2-ylacetic acid
CID 79018523
N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 768439
3-methoxy-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 7918037
3-(chloromethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 81408549
4-amino-3-methyl-N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 81408416
3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 31110060
3-methyl-4-(methylamino)-N-(1-thiophen-2-ylethyl)benzamide
CID 63210486
4-benzoyl-N-(1-thiophen-2-ylethyl)benzamide
CID 17431646
N-(2-hydroxy-2-thiophen-2-ylethyl)-3-methylbenzamide
CID 82121701

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide?
The IUPAC name of 3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide (CID 7918060) is 3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide.
What is the SMILES notation for 3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide?
The canonical SMILES for 3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide is Cc1cccc(C(=O)N[C@H](C)c2cccs2)c1.
What is the InChIKey of 3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide?
The InChIKey is ZOBJYYNGTKDERJ-LLVKDONJSA-N. The full InChI is InChI=1S/C14H15NOS/c1-10-5-3-6-12(9-10)14(16)15-11(2)13-7-4-8-17-13/h3-9,11H,1-2H3,(H,15,16)/t11-/m1/s1.
What are the key properties of 3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide?
3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide has a molecular weight of 245.35 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(1R)-1-thiophen-2-ylethyl]benzamide is sourced from PubChem (CID 7918060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).