N-benzyl-4-thiophen-2-ylbenzamide

C18H15NOS — CID 3677900

IUPACN-benzyl-4-thiophen-2-ylbenzamide
SMILESO=C(NCc1ccccc1)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C18H15NOS/c20-18(19-13-14-5-2-1-3-6-14)16-10-8-15(9-11-16)17-7-4-12-21-17/h1-12H,13H2,(H,19,20)
InChIKeyHIDMTWRKBLQTBL-UHFFFAOYSA-N
MW293.39 g/mol
LogP4.35
Rot. Bonds4

About N-benzyl-4-thiophen-2-ylbenzamide

N-benzyl-4-thiophen-2-ylbenzamide (PubChem CID 3677900) has the molecular formula C18H15NOS and a molecular weight of 293.39 g/mol. Its IUPAC name is N-benzyl-4-thiophen-2-ylbenzamide.

Molecular Properties

Compound NameN-benzyl-4-thiophen-2-ylbenzamide
PubChem CID3677900
Molecular FormulaC18H15NOS
Molecular Weight293.39 g/mol
Exact Mass293.09
IUPAC NameN-benzyl-4-thiophen-2-ylbenzamide
SMILESO=C(NCc1ccccc1)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C18H15NOS/c20-18(19-13-14-5-2-1-3-6-14)16-10-8-15(9-11-16)17-7-4-12-21-17/h1-12H,13H2,(H,19,20)
InChIKeyHIDMTWRKBLQTBL-UHFFFAOYSA-N
XLogP4.35
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-5-thiophen-2-ylphenyl)-4-(benzamidomethyl)benzamide
CID 25157373
5-[4-(benzylcarbamoyl)phenyl]-N-hydroxythiophene-2-carboxamide
CID 58968960
N-[4-(benzylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 2979144
N-benzyl-4-[4-(benzylcarbamoyl)benzoyl]benzamide
CID 20598592
2-chloro-N-[(4-thiophen-2-ylphenyl)methyl]acetamide
CID 146105331
N-benzylthiophene-2-carboxamide
CID 574227
N-benzyl-4-(hydroxymethyl)benzamide
CID 4125778
4-tert-butyl-N-[(5-thiophen-2-yl-3-pyridinyl)methyl]benzamide
CID 91630658
2-[[4-[(2-amino-5-thiophen-2-ylphenyl)carbamoyl]phenyl]methyl]-N,N'-dibenzylpropanediamide
CID 67279472
4-(4-thiophen-2-ylphenyl)benzoic acid
CID 53472759
N-[(4-methylphenyl)methyl]-4-phenylbenzamide
CID 1228171
3-[[(4-phenylbenzoyl)amino]methyl]benzoic acid
CID 108767634

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-thiophen-2-ylbenzamide?
The IUPAC name of N-benzyl-4-thiophen-2-ylbenzamide (CID 3677900) is N-benzyl-4-thiophen-2-ylbenzamide.
What is the SMILES notation for N-benzyl-4-thiophen-2-ylbenzamide?
The canonical SMILES for N-benzyl-4-thiophen-2-ylbenzamide is O=C(NCc1ccccc1)c1ccc(-c2cccs2)cc1.
What is the InChIKey of N-benzyl-4-thiophen-2-ylbenzamide?
The InChIKey is HIDMTWRKBLQTBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NOS/c20-18(19-13-14-5-2-1-3-6-14)16-10-8-15(9-11-16)17-7-4-12-21-17/h1-12H,13H2,(H,19,20).
What are the key properties of N-benzyl-4-thiophen-2-ylbenzamide?
N-benzyl-4-thiophen-2-ylbenzamide has a molecular weight of 293.39 g/mol, XLogP of 4.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-thiophen-2-ylbenzamide is sourced from PubChem (CID 3677900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).