4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide

C19H25N3O2S — CID 3902828

IUPAC4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
SMILESCN(C)c1ccc(C(=O)NCC(c2cccs2)N2CCOCC2)cc1
InChIInChI=1S/C19H25N3O2S/c1-21(2)16-7-5-15(6-8-16)19(23)20-14-17(18-4-3-13-25-18)22-9-11-24-12-10-22/h3-8,13,17H,9-12,14H2,1-2H3,(H,20,23)
InChIKeyPJLIVLWRABEYAQ-UHFFFAOYSA-N
MW359.50 g/mol
LogP2.62
Rot. Bonds6

About 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide

4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide (PubChem CID 3902828) has the molecular formula C19H25N3O2S and a molecular weight of 359.50 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
PubChem CID3902828
Molecular FormulaC19H25N3O2S
Molecular Weight359.50 g/mol
Exact Mass359.17
IUPAC Name4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
SMILESCN(C)c1ccc(C(=O)NCC(c2cccs2)N2CCOCC2)cc1
InChIInChI=1S/C19H25N3O2S/c1-21(2)16-7-5-15(6-8-16)19(23)20-14-17(18-4-3-13-25-18)22-9-11-24-12-10-22/h3-8,13,17H,9-12,14H2,1-2H3,(H,20,23)
InChIKeyPJLIVLWRABEYAQ-UHFFFAOYSA-N
XLogP2.62
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.50
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide (CID 3902828) is 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide is CN(C)c1ccc(C(=O)NCC(c2cccs2)N2CCOCC2)cc1.
What is the InChIKey of 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The InChIKey is PJLIVLWRABEYAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2S/c1-21(2)16-7-5-15(6-8-16)19(23)20-14-17(18-4-3-13-25-18)22-9-11-24-12-10-22/h3-8,13,17H,9-12,14H2,1-2H3,(H,20,23).
What are the key properties of 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide has a molecular weight of 359.50 g/mol, XLogP of 2.62, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide is sourced from PubChem (CID 3902828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).