N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide

C19H25N3O2S — CID 166239851

IUPACN,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide
SMILESCc1cc(C(=O)N(C)CC(C)c2nccs2)ccc1N1CCOCC1
InChIInChI=1S/C19H25N3O2S/c1-14-12-16(4-5-17(14)22-7-9-24-10-8-22)19(23)21(3)13-15(2)18-20-6-11-25-18/h4-6,11-12,15H,7-10,13H2,1-3H3
InChIKeyONJWGCIUKLVYAU-UHFFFAOYSA-N
MW359.50 g/mol
LogP3.16
Rot. Bonds5

About N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide

N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide (PubChem CID 166239851) has the molecular formula C19H25N3O2S and a molecular weight of 359.50 g/mol. Its IUPAC name is N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide.

Molecular Properties

Compound NameN,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide
PubChem CID166239851
Molecular FormulaC19H25N3O2S
Molecular Weight359.50 g/mol
Exact Mass359.17
IUPAC NameN,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide
SMILESCc1cc(C(=O)N(C)CC(C)c2nccs2)ccc1N1CCOCC1
InChIInChI=1S/C19H25N3O2S/c1-14-12-16(4-5-17(14)22-7-9-24-10-8-22)19(23)21(3)13-15(2)18-20-6-11-25-18/h4-6,11-12,15H,7-10,13H2,1-3H3
InChIKeyONJWGCIUKLVYAU-UHFFFAOYSA-N
XLogP3.16
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.50
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide?
The IUPAC name of N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide (CID 166239851) is N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide.
What is the SMILES notation for N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide?
The canonical SMILES for N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide is Cc1cc(C(=O)N(C)CC(C)c2nccs2)ccc1N1CCOCC1.
What is the InChIKey of N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide?
The InChIKey is ONJWGCIUKLVYAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2S/c1-14-12-16(4-5-17(14)22-7-9-24-10-8-22)19(23)21(3)13-15(2)18-20-6-11-25-18/h4-6,11-12,15H,7-10,13H2,1-3H3.
What are the key properties of N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide?
N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide has a molecular weight of 359.50 g/mol, XLogP of 3.16, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-4-morpholin-4-yl-N-[2-(1,3-thiazol-2-yl)propyl]benzamide is sourced from PubChem (CID 166239851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).