2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide

C20H26N2O2S — CID 110296595

IUPAC2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide
SMILESCc1ccc(C(Cc2cccs2)C(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C20H26N2O2S/c1-16-4-6-17(7-5-16)19(15-18-3-2-14-25-18)20(23)21-8-9-22-10-12-24-13-11-22/h2-7,14,19H,8-13,15H2,1H3,(H,21,23)
InChIKeyDUZMYOHWXWJXGV-UHFFFAOYSA-N
MW358.51 g/mol
LogP2.83
Rot. Bonds7

About 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide

2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide (PubChem CID 110296595) has the molecular formula C20H26N2O2S and a molecular weight of 358.51 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide
PubChem CID110296595
Molecular FormulaC20H26N2O2S
Molecular Weight358.51 g/mol
Exact Mass358.17
IUPAC Name2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide
SMILESCc1ccc(C(Cc2cccs2)C(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C20H26N2O2S/c1-16-4-6-17(7-5-16)19(15-18-3-2-14-25-18)20(23)21-8-9-22-10-12-24-13-11-22/h2-7,14,19H,8-13,15H2,1H3,(H,21,23)
InChIKeyDUZMYOHWXWJXGV-UHFFFAOYSA-N
XLogP2.83
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.51
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide
CID 110355487
N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-2-thiophen-2-ylacetamide
CID 51925350
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484
2-(4-methylphenoxy)-N-(2-morpholin-4-ylethyl)propanamide
CID 51163883
N-[(2S)-1-hydroxypropan-2-yl]-2-(4-methylphenyl)-3-thiophen-2-ylpropanamide
CID 110306927
N-(4-acetamidophenyl)-2-(4-methylphenyl)-3-thiophen-2-ylpropanamide
CID 110296604
2-amino-2-(4-methylphenyl)-N-(3-morpholin-4-ylpropyl)acetamide;dihydrochloride
CID 120669272
N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide
CID 110625276
1-[(4-methylphenyl)methyl]-3-(2-morpholin-4-ylethyl)urea
CID 33427522
(2R)-2-[4-(2-methylpropyl)phenyl]-N-(2-morpholin-4-ylethyl)propanamide
CID 121452302
5-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)thiadiazole-4-carboxamide
CID 71688703
2-amino-N-(2-morpholin-4-ylethyl)-2-phenylacetamide;dihydrochloride
CID 119827759

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide?
The IUPAC name of 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide (CID 110296595) is 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide?
The canonical SMILES for 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide is Cc1ccc(C(Cc2cccs2)C(=O)NCCN2CCOCC2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide?
The InChIKey is DUZMYOHWXWJXGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2S/c1-16-4-6-17(7-5-16)19(15-18-3-2-14-25-18)20(23)21-8-9-22-10-12-24-13-11-22/h2-7,14,19H,8-13,15H2,1H3,(H,21,23).
What are the key properties of 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide?
2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide has a molecular weight of 358.51 g/mol, XLogP of 2.83, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide is sourced from PubChem (CID 110296595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).