2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide

C18H24N2O2S — CID 86909948

IUPAC2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide
SMILESCCN(Cc1cccs1)C(C)C(=O)NCc1ccccc1OC
InChIInChI=1S/C18H24N2O2S/c1-4-20(13-16-9-7-11-23-16)14(2)18(21)19-12-15-8-5-6-10-17(15)22-3/h5-11,14H,4,12-13H2,1-3H3,(H,19,21)
InChIKeyYQBWFCMBRFROEA-UHFFFAOYSA-N
MW332.47 g/mol
LogP3.28
Rot. Bonds8

About 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide

2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide (PubChem CID 86909948) has the molecular formula C18H24N2O2S and a molecular weight of 332.47 g/mol. Its IUPAC name is 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide
PubChem CID86909948
Molecular FormulaC18H24N2O2S
Molecular Weight332.47 g/mol
Exact Mass332.16
IUPAC Name2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide
SMILESCCN(Cc1cccs1)C(C)C(=O)NCc1ccccc1OC
InChIInChI=1S/C18H24N2O2S/c1-4-20(13-16-9-7-11-23-16)14(2)18(21)19-12-15-8-5-6-10-17(15)22-3/h5-11,14H,4,12-13H2,1-3H3,(H,19,21)
InChIKeyYQBWFCMBRFROEA-UHFFFAOYSA-N
XLogP3.28
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.47
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]acetamide
CID 41375506
1-[(2-methoxyphenyl)methyl]-3-(thiophen-2-ylmethyl)urea
CID 38159170
(2S)-2-[ethyl(thiophen-2-ylmethyl)amino]-N-naphthalen-1-ylpropanamide
CID 8718468
2-[ethyl-[2-(4-methoxyanilino)-2-oxoethyl]amino]-N-(thiophen-2-ylmethyl)propanamide
CID 18094706
2-ethyl-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)butanamide
CID 112795027
N-[(2-methoxyphenyl)methyl]-2-(methylamino)-N-(thiophen-2-ylmethyl)acetamide
CID 119685026
N-[(2-methoxyphenyl)methyl]-2-methyl-N-(thiophen-2-ylmethyl)pentanamide
CID 112795029
(2S)-2-[ethyl(thiophen-2-ylmethyl)amino]-N-(4-propan-2-ylphenyl)propanamide
CID 8718457
N-[(2-methoxyphenyl)methyl]thiophene-2-carboxamide
CID 755236
2-[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]-N-pentan-2-ylacetamide
CID 46614580
2-[[benzyl(thiophen-2-ylmethyl)carbamothioyl]amino]-N-[(2-methoxyphenyl)methyl]acetamide
CID 3510122
1-[(2-methoxyphenyl)methyl]-2-methyl-3-(thiophen-2-ylmethyl)guanidine
CID 111215477

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide?
The IUPAC name of 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide (CID 86909948) is 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide.
What is the SMILES notation for 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide?
The canonical SMILES for 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide is CCN(Cc1cccs1)C(C)C(=O)NCc1ccccc1OC.
What is the InChIKey of 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide?
The InChIKey is YQBWFCMBRFROEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2S/c1-4-20(13-16-9-7-11-23-16)14(2)18(21)19-12-15-8-5-6-10-17(15)22-3/h5-11,14H,4,12-13H2,1-3H3,(H,19,21).
What are the key properties of 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide?
2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide has a molecular weight of 332.47 g/mol, XLogP of 3.28, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(thiophen-2-ylmethyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide is sourced from PubChem (CID 86909948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).