2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide

C20H20N2O2S — CID 67510388

IUPAC2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide
SMILESCc1ccc(OC(C)C(=O)N(Cc2cccs2)c2ccccn2)cc1
InChIInChI=1S/C20H20N2O2S/c1-15-8-10-17(11-9-15)24-16(2)20(23)22(14-18-6-5-13-25-18)19-7-3-4-12-21-19/h3-13,16H,14H2,1-2H3
InChIKeyADMUIELQAIDWTL-UHFFFAOYSA-N
MW352.46 g/mol
LogP4.45
Rot. Bonds6

About 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide

2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide (PubChem CID 67510388) has the molecular formula C20H20N2O2S and a molecular weight of 352.46 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide
PubChem CID67510388
Molecular FormulaC20H20N2O2S
Molecular Weight352.46 g/mol
Exact Mass352.12
IUPAC Name2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide
SMILESCc1ccc(OC(C)C(=O)N(Cc2cccs2)c2ccccn2)cc1
InChIInChI=1S/C20H20N2O2S/c1-15-8-10-17(11-9-15)24-16(2)20(23)22(14-18-6-5-13-25-18)19-7-3-4-12-21-19/h3-13,16H,14H2,1-2H3
InChIKeyADMUIELQAIDWTL-UHFFFAOYSA-N
XLogP4.45
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)propanamide
CID 67512330
2-(3,5-dimethylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 17012481
N-benzyl-2-(3,4-dimethylphenoxy)-N-pyridin-2-ylpropanamide
CID 18830895
2-(3-chlorophenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 17012479
2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)propanamide
CID 42994656
(2S)-N-[(2-chloro-6-fluorophenyl)methyl]-2-(4-ethylphenoxy)-N-pyridin-2-ylpropanamide
CID 35576773
2-(4-cyanophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)propanamide
CID 51158213
1-pyridin-2-yl-1-(thiophen-2-ylmethyl)hydrazine
CID 70449715
(2S)-2-(4-chloro-3,5-dimethylphenoxy)-N-pyridin-2-yl-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide
CID 35041654
N-(2-hydroxyphenyl)-2-(4-methoxyphenoxy)-N-(pyridin-2-ylmethyl)propanamide
CID 108732542
2-(2-cyanophenoxy)-N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)propanamide
CID 55525855
2-(4-methylphenoxy)-3-thiophen-2-ylpropanamide
CID 135281307

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide?
The IUPAC name of 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide (CID 67510388) is 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide is Cc1ccc(OC(C)C(=O)N(Cc2cccs2)c2ccccn2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide?
The InChIKey is ADMUIELQAIDWTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2S/c1-15-8-10-17(11-9-15)24-16(2)20(23)22(14-18-6-5-13-25-18)19-7-3-4-12-21-19/h3-13,16H,14H2,1-2H3.
What are the key properties of 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide?
2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide has a molecular weight of 352.46 g/mol, XLogP of 4.45, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)propanamide is sourced from PubChem (CID 67510388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).