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

C22H25NO3S — CID 2957599

IUPACN-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide
SMILESCCC(=O)N(CCC(c1ccco1)c1ccccc1OC)Cc1cccs1
InChIInChI=1S/C22H25NO3S/c1-3-22(24)23(16-17-8-7-15-27-17)13-12-19(21-11-6-14-26-21)18-9-4-5-10-20(18)25-2/h4-11,14-15,19H,3,12-13,16H2,1-2H3
InChIKeyYGXGUKLXHMRBFR-UHFFFAOYSA-N
MW383.51 g/mol
LogP5.31
Rot. Bonds9

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

N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide (PubChem CID 2957599) has the molecular formula C22H25NO3S and a molecular weight of 383.51 g/mol. Its IUPAC name is N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide.

Molecular Properties

Compound NameN-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide
PubChem CID2957599
Molecular FormulaC22H25NO3S
Molecular Weight383.51 g/mol
Exact Mass383.16
IUPAC NameN-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide
SMILESCCC(=O)N(CCC(c1ccco1)c1ccccc1OC)Cc1cccs1
InChIInChI=1S/C22H25NO3S/c1-3-22(24)23(16-17-8-7-15-27-17)13-12-19(21-11-6-14-26-21)18-9-4-5-10-20(18)25-2/h4-11,14-15,19H,3,12-13,16H2,1-2H3
InChIKeyYGXGUKLXHMRBFR-UHFFFAOYSA-N
XLogP5.31
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.51
LogP ≤ 55.31
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
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
N-(furan-2-ylmethyl)-4-methyl-N-[(3-methylthiophen-2-yl)methyl]benzamide
CID 16014246

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide?
The IUPAC name of N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide (CID 2957599) is N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide.
What is the SMILES notation for N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide?
The canonical SMILES for N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide is CCC(=O)N(CCC(c1ccco1)c1ccccc1OC)Cc1cccs1.
What is the InChIKey of N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide?
The InChIKey is YGXGUKLXHMRBFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25NO3S/c1-3-22(24)23(16-17-8-7-15-27-17)13-12-19(21-11-6-14-26-21)18-9-4-5-10-20(18)25-2/h4-11,14-15,19H,3,12-13,16H2,1-2H3.
What are the key properties of N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide?
N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-N-(thiophen-2-ylmethyl)propanamide has a molecular weight of 383.51 g/mol, XLogP of 5.31, 9 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)propanamide is sourced from PubChem (CID 2957599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).