N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide

C19H22N2O3S — CID 110352787

IUPACN-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide
SMILESCC1(C)COCCN1C(=O)c1ccc(NC(=O)Cc2cccs2)cc1
InChIInChI=1S/C19H22N2O3S/c1-19(2)13-24-10-9-21(19)18(23)14-5-7-15(8-6-14)20-17(22)12-16-4-3-11-25-16/h3-8,11H,9-10,12-13H2,1-2H3,(H,20,22)
InChIKeyCUGCZENGKOLPNV-UHFFFAOYSA-N
MW358.46 g/mol
LogP3.18
Rot. Bonds4

About N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide

N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide (PubChem CID 110352787) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide
PubChem CID110352787
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC NameN-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide
SMILESCC1(C)COCCN1C(=O)c1ccc(NC(=O)Cc2cccs2)cc1
InChIInChI=1S/C19H22N2O3S/c1-19(2)13-24-10-9-21(19)18(23)14-5-7-15(8-6-14)20-17(22)12-16-4-3-11-25-16/h3-8,11H,9-10,12-13H2,1-2H3,(H,20,22)
InChIKeyCUGCZENGKOLPNV-UHFFFAOYSA-N
XLogP3.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-3-phenylurea
CID 110352798
N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]morpholine-4-carboxamide
CID 110352817
N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-(2-methoxyphenoxy)acetamide
CID 110352809
N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]adamantane-1-carboxamide
CID 110352818
N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2,6-dimethoxybenzamide
CID 110352783
N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-3,4-dimethylbenzamide
CID 110352784
N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]oxolane-2-carboxamide
CID 110352768
N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2,3,4-trifluorobenzamide
CID 110352811
4-[(3,3-dimethylmorpholine-4-carbonyl)amino]benzoic acid
CID 61427841
N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide
CID 8698592
N-[3-(3,3-dimethylmorpholine-4-carbonyl)phenyl]pentanamide
CID 110353014
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-thiophen-2-ylacetamide
CID 7744758

Frequently Asked Questions

What is the IUPAC name of N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide (CID 110352787) is N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide is CC1(C)COCCN1C(=O)c1ccc(NC(=O)Cc2cccs2)cc1.
What is the InChIKey of N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide?
The InChIKey is CUGCZENGKOLPNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-19(2)13-24-10-9-21(19)18(23)14-5-7-15(8-6-14)20-17(22)12-16-4-3-11-25-16/h3-8,11H,9-10,12-13H2,1-2H3,(H,20,22).
What are the key properties of N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide?
N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide has a molecular weight of 358.46 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3,3-dimethylmorpholine-4-carbonyl)phenyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 110352787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).