3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide

C22H23NO2S — CID 24613748

IUPAC3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide
SMILESCOc1ccccc1CCC(=O)NC(c1ccc(C)cc1)c1cccs1
InChIInChI=1S/C22H23NO2S/c1-16-9-11-18(12-10-16)22(20-8-5-15-26-20)23-21(24)14-13-17-6-3-4-7-19(17)25-2/h3-12,15,22H,13-14H2,1-2H3,(H,23,24)
InChIKeyQSYBVZITOCKESV-UHFFFAOYSA-N
MW365.50 g/mol
LogP4.90
Rot. Bonds7

About 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide

3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide (PubChem CID 24613748) has the molecular formula C22H23NO2S and a molecular weight of 365.50 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide
PubChem CID24613748
Molecular FormulaC22H23NO2S
Molecular Weight365.50 g/mol
Exact Mass365.14
IUPAC Name3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide
SMILESCOc1ccccc1CCC(=O)NC(c1ccc(C)cc1)c1cccs1
InChIInChI=1S/C22H23NO2S/c1-16-9-11-18(12-10-16)22(20-8-5-15-26-20)23-21(24)14-13-17-6-3-4-7-19(17)25-2/h3-12,15,22H,13-14H2,1-2H3,(H,23,24)
InChIKeyQSYBVZITOCKESV-UHFFFAOYSA-N
XLogP4.90
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.50
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxy-5-methylphenyl)-N-[phenyl(thiophen-2-yl)methyl]acetamide
CID 24682654
3-(1,3-dioxoisoindol-2-yl)-N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]propanamide
CID 8854781
3-(4-methoxyphenyl)-N-[(S)-phenyl(thiophen-2-yl)methyl]propanamide
CID 8854024
N-[(R)-(4-methylphenyl)-thiophen-2-ylmethyl]-3-(2-methylpyrazol-3-yl)propanamide
CID 99945826
(2-methoxy-5-methylphenyl)methyl-methyl-[2-oxo-2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]ethyl]azanium
CID 8805898
[2-[[(R)-(4-fluorophenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl]-[(2-methoxy-5-methylphenyl)methyl]-methylazanium
CID 8805882
N-[2-(2-methoxyphenoxy)ethyl]-2-[[(R)-(4-methylphenyl)-thiophen-2-ylmethyl]amino]acetamide
CID 8869023
[2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 2-(4-methylphenyl)acetate
CID 46611974
N-[(2-methoxyphenyl)methyl]-2-[[(S)-(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]amino]acetamide
CID 8997945
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-3-(1H-indol-3-yl)propanamide
CID 17494432
N-[(S)-(4-ethylphenyl)-thiophen-2-ylmethyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 7669917
3,5-dimethoxy-N-[(4-methylphenyl)-thiophen-2-ylmethyl]benzamide
CID 17488923

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide?
The IUPAC name of 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide (CID 24613748) is 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide.
What is the SMILES notation for 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide?
The canonical SMILES for 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide is COc1ccccc1CCC(=O)NC(c1ccc(C)cc1)c1cccs1.
What is the InChIKey of 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide?
The InChIKey is QSYBVZITOCKESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2S/c1-16-9-11-18(12-10-16)22(20-8-5-15-26-20)23-21(24)14-13-17-6-3-4-7-19(17)25-2/h3-12,15,22H,13-14H2,1-2H3,(H,23,24).
What are the key properties of 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide?
3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide has a molecular weight of 365.50 g/mol, XLogP of 4.90, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]propanamide is sourced from PubChem (CID 24613748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).