2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide

C20H17N3O2S2 — CID 31839493

IUPAC2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide
SMILESO=C(Cn1c(=O)cnc2ccccc21)N(Cc1cccs1)Cc1cccs1
InChIInChI=1S/C20H17N3O2S2/c24-19-11-21-17-7-1-2-8-18(17)23(19)14-20(25)22(12-15-5-3-9-26-15)13-16-6-4-10-27-16/h1-11H,12-14H2
InChIKeyXHZUIXSNDZNXQW-UHFFFAOYSA-N
MW395.51 g/mol
LogP3.75
Rot. Bonds6

About 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide

2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide (PubChem CID 31839493) has the molecular formula C20H17N3O2S2 and a molecular weight of 395.51 g/mol. Its IUPAC name is 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide
PubChem CID31839493
Molecular FormulaC20H17N3O2S2
Molecular Weight395.51 g/mol
Exact Mass395.08
IUPAC Name2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide
SMILESO=C(Cn1c(=O)cnc2ccccc21)N(Cc1cccs1)Cc1cccs1
InChIInChI=1S/C20H17N3O2S2/c24-19-11-21-17-7-1-2-8-18(17)23(19)14-20(25)22(12-15-5-3-9-26-15)13-16-6-4-10-27-16/h1-11H,12-14H2
InChIKeyXHZUIXSNDZNXQW-UHFFFAOYSA-N
XLogP3.75
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.51
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-oxoquinoxalin-1-yl)-N-(2-phenylethyl)-N-(thiophen-2-ylmethyl)acetamide
CID 17409812
N-ethyl-N-[(3-fluorophenyl)methyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 31977722
N-ethyl-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-(thiophen-2-ylmethyl)acetamide
CID 55439304
N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(2-oxoquinoxalin-1-yl)acetamide
CID 26419188
2-[4-[2-[bis(thiophen-2-ylmethyl)amino]-2-oxoethyl]piperazin-1-yl]-N,N-bis(thiophen-2-ylmethyl)acetamide
CID 168975865
2-[2-(difluoromethylsulfanyl)benzimidazol-1-yl]-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)acetamide
CID 43022686
2-(2-oxoquinoxalin-1-yl)-N-[4-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]phenyl]acetamide
CID 166181883
2-(2-oxoquinoxalin-1-yl)-N-phenylacetamide
CID 4805436
2-(benzimidazol-1-yl)-N-cyclopropyl-N-(thiophen-2-ylmethyl)acetamide
CID 91641807
1-(fluoromethyl)quinoxalin-2-one
CID 140968709
2-(benzotriazol-1-yl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 47007781
N-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-N-ethyl-2-(2-oxoquinoxalin-1-yl)acetamide
CID 24686704

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide (CID 31839493) is 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide is O=C(Cn1c(=O)cnc2ccccc21)N(Cc1cccs1)Cc1cccs1.
What is the InChIKey of 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide?
The InChIKey is XHZUIXSNDZNXQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O2S2/c24-19-11-21-17-7-1-2-8-18(17)23(19)14-20(25)22(12-15-5-3-9-26-15)13-16-6-4-10-27-16/h1-11H,12-14H2.
What are the key properties of 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide?
2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide has a molecular weight of 395.51 g/mol, XLogP of 3.75, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxoquinoxalin-1-yl)-N,N-bis(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 31839493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).