N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide

C21H23NO3S — CID 662195

IUPACN-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide
SMILESCOc1ccccc1C(CCN(Cc1cccs1)C(C)=O)c1ccco1
InChIInChI=1S/C21H23NO3S/c1-16(23)22(15-17-7-6-14-26-17)12-11-19(21-10-5-13-25-21)18-8-3-4-9-20(18)24-2/h3-10,13-14,19H,11-12,15H2,1-2H3
InChIKeyVETNKIMIPJMVSA-UHFFFAOYSA-N
MW369.49 g/mol
LogP4.92
Rot. Bonds8

About N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide

N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 662195) has the molecular formula C21H23NO3S and a molecular weight of 369.49 g/mol. Its IUPAC name is N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide
PubChem CID662195
Molecular FormulaC21H23NO3S
Molecular Weight369.49 g/mol
Exact Mass369.14
IUPAC NameN-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide
SMILESCOc1ccccc1C(CCN(Cc1cccs1)C(C)=O)c1ccco1
InChIInChI=1S/C21H23NO3S/c1-16(23)22(15-17-7-6-14-26-17)12-11-19(21-10-5-13-25-21)18-8-3-4-9-20(18)24-2/h3-10,13-14,19H,11-12,15H2,1-2H3
InChIKeyVETNKIMIPJMVSA-UHFFFAOYSA-N
XLogP4.92
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.49
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-fluorophenyl)-3-(furan-2-yl)-N-(thiophen-2-ylmethyl)propan-1-amine
CID 3994494
[4-(2-Methoxyphenyl)piperidino](2-thienyl)methanone
CID 574275
(3-Furan-2-yl-3-p-tolyl-propyl)-(1-thiophen-2-yl-ethyl)-amine
CID 3366871
Thiophene-2-carboxylic acid [(furan-2-ylmethyl)-carbamoyl]-(2-methoxy-phenyl)-methyl ester
CID 646791
N-(2-furanylmethyl)-5-methyl-4-phenyl-3-thiophenecarboxamide
CID 1245893
2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-(thiophen-2-ylmethyl)acetamide
CID 2469541
N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide
CID 2938128
N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide
CID 2957599
pyrrolidin-1-yl(4H-thieno[3,2-c]chromen-2-yl)methanone
CID 5309238
N-[(Furan-2-YL)methyl]-N-(3-methylbutyl)-4H-thieno[3,2-C]chromene-2-carboxamide
CID 16010312
N-[2-(Dimethylamino)ethyl]-N-[(furan-2-YL)methyl]-4H-thieno[3,2-C]chromene-2-carboxamide
CID 16010314
N-(3-Ethoxypropyl)-N-[(furan-2-YL)methyl]-9-methyl-4H-thieno[3,2-C]chromene-2-carboxamide
CID 16010474

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide (CID 662195) is N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide is COc1ccccc1C(CCN(Cc1cccs1)C(C)=O)c1ccco1.
What is the InChIKey of N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is VETNKIMIPJMVSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NO3S/c1-16(23)22(15-17-7-6-14-26-17)12-11-19(21-10-5-13-25-21)18-8-3-4-9-20(18)24-2/h3-10,13-14,19H,11-12,15H2,1-2H3.
What are the key properties of N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide?
N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 369.49 g/mol, XLogP of 4.92, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 662195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).