N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

C18H16N2OS — CID 1139360

IUPACN-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCCN(C(=O)c1ccccc1)c1nc(-c2ccccc2)cs1
InChIInChI=1S/C18H16N2OS/c1-2-20(17(21)15-11-7-4-8-12-15)18-19-16(13-22-18)14-9-5-3-6-10-14/h3-13H,2H2,1H3
InChIKeyIXBYSHNIINAYHZ-UHFFFAOYSA-N
MW308.41 g/mol
LogP4.48
Rot. Bonds4

About N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (PubChem CID 1139360) has the molecular formula C18H16N2OS and a molecular weight of 308.41 g/mol. Its IUPAC name is N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound NameN-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
PubChem CID1139360
Molecular FormulaC18H16N2OS
Molecular Weight308.41 g/mol
Exact Mass308.10
IUPAC NameN-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCCN(C(=O)c1ccccc1)c1nc(-c2ccccc2)cs1
InChIInChI=1S/C18H16N2OS/c1-2-20(17(21)15-11-7-4-8-12-15)18-19-16(13-22-18)14-9-5-3-6-10-14/h3-13H,2H2,1H3
InChIKeyIXBYSHNIINAYHZ-UHFFFAOYSA-N
XLogP4.48
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

L 006235
CID 9912381
4-Methyl-N-(4-phenyl-2-thiazolyl)benzamide
CID 577347
4-Chloro-N-(4-phenyl-thiazol-2-yl)-benzamide
CID 697415
N-(4-Phenyl-thiazol-2-yl)-benzamide
CID 746475
3-Chloro-N-(4-phenyl-thiazol-2-yl)-benzamide
CID 754492
N-(4-methylthiazol-2-yl)benzamide
CID 695178
T0400-1499
CID 1549394
2-Cinnamamido-4-phenylthiazole
CID 690181
4-bromo-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 988802
N-(4-Phenyl-1,3-thiazol-2-yl)-7-sulfanyl-heptanamide
CID 11427204
(2S)-2-[(1-methylpiperidin-2-yl)formamido]-8-oxo-N-(4-phenyl-1,3-thiazol-2-yl)nonanamide
CID 16036765
4-tert-butyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 824266

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (CID 1139360) is N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is CCN(C(=O)c1ccccc1)c1nc(-c2ccccc2)cs1.
What is the InChIKey of N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is IXBYSHNIINAYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2OS/c1-2-20(17(21)15-11-7-4-8-12-15)18-19-16(13-22-18)14-9-5-3-6-10-14/h3-13H,2H2,1H3.
What are the key properties of N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 308.41 g/mol, XLogP of 4.48, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 1139360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).