2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide

C20H29N3O3S — CID 26513187

IUPAC2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
SMILESCC(C)(CNC(=O)CN(Cc1ccco1)Cc1cccs1)N1CCOCC1
InChIInChI=1S/C20H29N3O3S/c1-20(2,23-7-10-25-11-8-23)16-21-19(24)15-22(13-17-5-3-9-26-17)14-18-6-4-12-27-18/h3-6,9,12H,7-8,10-11,13-16H2,1-2H3,(H,21,24)
InChIKeyKJUGYZQFKNPXEC-UHFFFAOYSA-N
MW391.54 g/mol
LogP2.57
Rot. Bonds9

About 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide

2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide (PubChem CID 26513187) has the molecular formula C20H29N3O3S and a molecular weight of 391.54 g/mol. Its IUPAC name is 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide.

Molecular Properties

Compound Name2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
PubChem CID26513187
Molecular FormulaC20H29N3O3S
Molecular Weight391.54 g/mol
Exact Mass391.19
IUPAC Name2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
SMILESCC(C)(CNC(=O)CN(Cc1ccco1)Cc1cccs1)N1CCOCC1
InChIInChI=1S/C20H29N3O3S/c1-20(2,23-7-10-25-11-8-23)16-21-19(24)15-22(13-17-5-3-9-26-17)14-18-6-4-12-27-18/h3-6,9,12H,7-8,10-11,13-16H2,1-2H3,(H,21,24)
InChIKeyKJUGYZQFKNPXEC-UHFFFAOYSA-N
XLogP2.57
TPSA57.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.54
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methyl-2-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide
CID 47005477
N-(2,6-dimethylphenyl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8677649
N-[(4-chlorophenyl)methyl]-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8677619
N-(2-cyano-3-methylbutan-2-yl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 78752041
N-(4-chlorophenyl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8677854
N-(cyclopropylcarbamoyl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8678412
1-(2-methyl-2-morpholin-4-ylpropyl)-3-(thiophen-2-ylmethyl)thiourea
CID 46800506
N-[(3,4-dimethoxyphenyl)methyl]-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8678042
N-(2,3-dimethylphenyl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8677595
N-(2-methyl-2-pyrrolidin-1-ylpropyl)-5-thiophen-2-ylpentanamide
CID 110303146
2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(3-phenylmethoxypropyl)acetamide
CID 24574934
N-(1-adamantylcarbamoyl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8678198

Frequently Asked Questions

What is the IUPAC name of 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide?
The IUPAC name of 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide (CID 26513187) is 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide.
What is the SMILES notation for 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide?
The canonical SMILES for 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide is CC(C)(CNC(=O)CN(Cc1ccco1)Cc1cccs1)N1CCOCC1.
What is the InChIKey of 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide?
The InChIKey is KJUGYZQFKNPXEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3S/c1-20(2,23-7-10-25-11-8-23)16-21-19(24)15-22(13-17-5-3-9-26-17)14-18-6-4-12-27-18/h3-6,9,12H,7-8,10-11,13-16H2,1-2H3,(H,21,24).
What are the key properties of 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide?
2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide has a molecular weight of 391.54 g/mol, XLogP of 2.57, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide is sourced from PubChem (CID 26513187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).