3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide

C17H18N4O3S — CID 32863174

IUPAC3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide
SMILESCC(=O)Nc1cc(NC(C)=O)cc(C(=O)Nc2nc(C3CC3)cs2)c1
InChIInChI=1S/C17H18N4O3S/c1-9(22)18-13-5-12(6-14(7-13)19-10(2)23)16(24)21-17-20-15(8-25-17)11-3-4-11/h5-8,11H,3-4H2,1-2H3,(H,18,22)(H,19,23)(H,20,21,24)
InChIKeyCABLUVJAJKTUEF-UHFFFAOYSA-N
MW358.42 g/mol
LogP3.19
Rot. Bonds5

About 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide

3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide (PubChem CID 32863174) has the molecular formula C17H18N4O3S and a molecular weight of 358.42 g/mol. Its IUPAC name is 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide
PubChem CID32863174
Molecular FormulaC17H18N4O3S
Molecular Weight358.42 g/mol
Exact Mass358.11
IUPAC Name3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide
SMILESCC(=O)Nc1cc(NC(C)=O)cc(C(=O)Nc2nc(C3CC3)cs2)c1
InChIInChI=1S/C17H18N4O3S/c1-9(22)18-13-5-12(6-14(7-13)19-10(2)23)16(24)21-17-20-15(8-25-17)11-3-4-11/h5-8,11H,3-4H2,1-2H3,(H,18,22)(H,19,23)(H,20,21,24)
InChIKeyCABLUVJAJKTUEF-UHFFFAOYSA-N
XLogP3.19
TPSA100.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.42
LogP ≤ 53.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-N,4-N-bis(4-cyclopropyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 32869371
3,5-dibromo-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide
CID 107980376
3-bromo-N-(4-cyclopropyl-1,3-thiazol-2-yl)-5-methylbenzamide
CID 104852540
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3,5-dimethoxy-4-methylbenzamide
CID 32863513
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3,5-difluoro-4-hydrazinylbenzamide
CID 63186693
4-bromo-N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-methylbenzamide
CID 112705830
N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-[(R)-methylsulfinyl]benzamide
CID 94198052
5-bromo-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 32865110
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-fluoropyridine-4-carboxamide
CID 54958473
(2S)-2-acetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)propanamide
CID 32864950
N-(4-cyclopropyl-1,3-thiazol-2-yl)-6-(methylamino)pyridine-3-carboxamide
CID 62174816
3-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-fluorobenzamide
CID 61479305

Frequently Asked Questions

What is the IUPAC name of 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide (CID 32863174) is 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide is CC(=O)Nc1cc(NC(C)=O)cc(C(=O)Nc2nc(C3CC3)cs2)c1.
What is the InChIKey of 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is CABLUVJAJKTUEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3S/c1-9(22)18-13-5-12(6-14(7-13)19-10(2)23)16(24)21-17-20-15(8-25-17)11-3-4-11/h5-8,11H,3-4H2,1-2H3,(H,18,22)(H,19,23)(H,20,21,24).
What are the key properties of 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide?
3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 358.42 g/mol, XLogP of 3.19, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diacetamido-N-(4-cyclopropyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 32863174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).