3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide

C19H18N2O2S2 — CID 17409595

IUPAC3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)N(Cc2cccs2)Cc2cccs2)c1
InChIInChI=1S/C19H18N2O2S2/c1-14(22)20-16-6-2-5-15(11-16)19(23)21(12-17-7-3-9-24-17)13-18-8-4-10-25-18/h2-11H,12-13H2,1H3,(H,20,22)
InChIKeyUDGFZUHPEQMWHY-UHFFFAOYSA-N
MW370.50 g/mol
LogP4.61
Rot. Bonds6

About 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide

3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide (PubChem CID 17409595) has the molecular formula C19H18N2O2S2 and a molecular weight of 370.50 g/mol. Its IUPAC name is 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide
PubChem CID17409595
Molecular FormulaC19H18N2O2S2
Molecular Weight370.50 g/mol
Exact Mass370.08
IUPAC Name3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)N(Cc2cccs2)Cc2cccs2)c1
InChIInChI=1S/C19H18N2O2S2/c1-14(22)20-16-6-2-5-15(11-16)19(23)21(12-17-7-3-9-24-17)13-18-8-4-10-25-18/h2-11H,12-13H2,1H3,(H,20,22)
InChIKeyUDGFZUHPEQMWHY-UHFFFAOYSA-N
XLogP4.61
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,2-dimethylpropanoylamino)-N,N-bis(thiophen-2-ylmethyl)benzamide
CID 31841528
3-(2,2-dimethylpropanoylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)benzamide
CID 31836048
3,5-diacetamido-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 17429130
3-acetamido-N-[2-[(2-thiophen-2-ylacetyl)amino]ethyl]benzamide
CID 108541843
N,N-bis(thiophen-2-ylmethyl)-3-(trifluoromethyl)benzamide
CID 55438026
3-acetamido-N-[(5-chlorothiophen-2-yl)methyl]-N-ethylbenzamide
CID 34132033
3-amino-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 60940215
N-(furan-2-ylmethyl)-3-(pyrimidin-2-ylamino)-N-(thiophen-2-ylmethyl)benzamide
CID 31836707
N-[(Z)-1-(3-acetamidophenyl)ethylideneamino]-2-thiophen-2-ylacetamide
CID 7516727
N-ethyl-3-(N'-hydroxycarbamimidoyl)-N-(thiophen-2-ylmethyl)benzamide
CID 76904150
3-(3-thiophen-2-ylpropanoylamino)benzamide
CID 17436122
N-ethyl-3-(methylsulfonylmethyl)-N-(thiophen-2-ylmethyl)benzamide
CID 78811486

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide?
The IUPAC name of 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide (CID 17409595) is 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide is CC(=O)Nc1cccc(C(=O)N(Cc2cccs2)Cc2cccs2)c1.
What is the InChIKey of 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide?
The InChIKey is UDGFZUHPEQMWHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2S2/c1-14(22)20-16-6-2-5-15(11-16)19(23)21(12-17-7-3-9-24-17)13-18-8-4-10-25-18/h2-11H,12-13H2,1H3,(H,20,22).
What are the key properties of 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide?
3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide has a molecular weight of 370.50 g/mol, XLogP of 4.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N,N-bis(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 17409595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).