N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide

C18H22N2O2S — CID 110362509

IUPACN-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide
SMILESCc1ccc(N2CCOCC2)cc1NC(=O)CCc1cccs1
InChIInChI=1S/C18H22N2O2S/c1-14-4-5-15(20-8-10-22-11-9-20)13-17(14)19-18(21)7-6-16-3-2-12-23-16/h2-5,12-13H,6-11H2,1H3,(H,19,21)
InChIKeyHYZDXHNIMHYNDP-UHFFFAOYSA-N
MW330.45 g/mol
LogP3.46
Rot. Bonds5

About N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide

N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide (PubChem CID 110362509) has the molecular formula C18H22N2O2S and a molecular weight of 330.45 g/mol. Its IUPAC name is N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide.

Molecular Properties

Compound NameN-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide
PubChem CID110362509
Molecular FormulaC18H22N2O2S
Molecular Weight330.45 g/mol
Exact Mass330.14
IUPAC NameN-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide
SMILESCc1ccc(N2CCOCC2)cc1NC(=O)CCc1cccs1
InChIInChI=1S/C18H22N2O2S/c1-14-4-5-15(20-8-10-22-11-9-20)13-17(14)19-18(21)7-6-16-3-2-12-23-16/h2-5,12-13H,6-11H2,1H3,(H,19,21)
InChIKeyHYZDXHNIMHYNDP-UHFFFAOYSA-N
XLogP3.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.45
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-2-methylphenyl]-5-thiophen-2-ylpentanamide
CID 110302293
3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide
CID 46415307
N-[2-methyl-5-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-3-thiophen-2-ylpropanamide
CID 35015279
2-(4-chlorophenoxy)-N-(2-methyl-5-morpholin-4-ylphenyl)acetamide
CID 110362472
N-(3,4-dimethylphenyl)-3-(4-morpholin-4-ylphenyl)propanamide
CID 110649726
2-[methyl(thiophen-2-ylmethyl)amino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 8592090
N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide
CID 110425585
N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]-3-(4-thiophen-2-ylbutanoylamino)benzamide
CID 55966910
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-3-thiophen-2-ylpropanamide
CID 30843558
N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylpropanamide
CID 30547818
N-[2-methyl-5-[(3-morpholin-4-ylbenzoyl)amino]phenyl]thiophene-2-carboxamide
CID 11327642
2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide
CID 43822469

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide?
The IUPAC name of N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide (CID 110362509) is N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide.
What is the SMILES notation for N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide?
The canonical SMILES for N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide is Cc1ccc(N2CCOCC2)cc1NC(=O)CCc1cccs1.
What is the InChIKey of N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide?
The InChIKey is HYZDXHNIMHYNDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2S/c1-14-4-5-15(20-8-10-22-11-9-20)13-17(14)19-18(21)7-6-16-3-2-12-23-16/h2-5,12-13H,6-11H2,1H3,(H,19,21).
What are the key properties of N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide?
N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide has a molecular weight of 330.45 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide is sourced from PubChem (CID 110362509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).