4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide

C17H19NOS — CID 73067043

IUPAC4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide
SMILESCCCC=Cc1ccc(C(=O)NCc2cccs2)cc1
InChIInChI=1S/C17H19NOS/c1-2-3-4-6-14-8-10-15(11-9-14)17(19)18-13-16-7-5-12-20-16/h4-12H,2-3,13H2,1H3,(H,18,19)
InChIKeySTTUNUICPKOMMD-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.49
Rot. Bonds6

About 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide

4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 73067043) has the molecular formula C17H19NOS and a molecular weight of 285.41 g/mol. Its IUPAC name is 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide
PubChem CID73067043
Molecular FormulaC17H19NOS
Molecular Weight285.41 g/mol
Exact Mass285.12
IUPAC Name4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide
SMILESCCCC=Cc1ccc(C(=O)NCc2cccs2)cc1
InChIInChI=1S/C17H19NOS/c1-2-3-4-6-14-8-10-15(11-9-14)17(19)18-13-16-7-5-12-20-16/h4-12H,2-3,13H2,1H3,(H,18,19)
InChIKeySTTUNUICPKOMMD-UHFFFAOYSA-N
XLogP4.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-propoxy-N-(thiophen-2-ylmethyl)benzamide
CID 4938538
N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide
CID 59811460
4-[(E)-pent-1-enyl]-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 59811273
4-formamido-N-(thiophen-2-ylmethyl)benzamide
CID 168653022
3-bromo-4-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 79460548
4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide
CID 4882047
2,3-diethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide
CID 22588071
N-cyclopropyl-4-[(E)-3-oxo-3-(thiophen-2-ylmethylamino)prop-1-enyl]benzamide
CID 35561461
3,4-diamino-N-(thiophen-2-ylmethyl)benzamide
CID 67362450
5-tert-butyl-1-N,3-N-bis(thiophen-2-ylmethyl)benzene-1,3-dicarboxamide
CID 2801009
4-[(propan-2-ylcarbamoylamino)methyl]-N-(thiophen-2-ylmethyl)benzamide
CID 9374254
4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]-N-(thiophen-2-ylmethyl)benzamide
CID 134030447

Frequently Asked Questions

What is the IUPAC name of 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide (CID 73067043) is 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide is CCCC=Cc1ccc(C(=O)NCc2cccs2)cc1.
What is the InChIKey of 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is STTUNUICPKOMMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NOS/c1-2-3-4-6-14-8-10-15(11-9-14)17(19)18-13-16-7-5-12-20-16/h4-12H,2-3,13H2,1H3,(H,18,19).
What are the key properties of 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide?
4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 285.41 g/mol, XLogP of 4.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pent-1-enyl-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 73067043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).