N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide

C15H15N3O2S — CID 2574102

IUPACN-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESCc1csc(NC(=O)c2ccc(N3CCCC3=O)cc2)n1
InChIInChI=1S/C15H15N3O2S/c1-10-9-21-15(16-10)17-14(20)11-4-6-12(7-5-11)18-8-2-3-13(18)19/h4-7,9H,2-3,8H2,1H3,(H,16,17,20)
InChIKeyQZMBEWPNZAYGHO-UHFFFAOYSA-N
MW301.37 g/mol
LogP2.83
Rot. Bonds3

About N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide

N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 2574102) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID2574102
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESCc1csc(NC(=O)c2ccc(N3CCCC3=O)cc2)n1
InChIInChI=1S/C15H15N3O2S/c1-10-9-21-15(16-10)17-14(20)11-4-6-12(7-5-11)18-8-2-3-13(18)19/h4-7,9H,2-3,8H2,1H3,(H,16,17,20)
InChIKeyQZMBEWPNZAYGHO-UHFFFAOYSA-N
XLogP2.83
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide (CID 2574102) is N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide is Cc1csc(NC(=O)c2ccc(N3CCCC3=O)cc2)n1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is QZMBEWPNZAYGHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-10-9-21-15(16-10)17-14(20)11-4-6-12(7-5-11)18-8-2-3-13(18)19/h4-7,9H,2-3,8H2,1H3,(H,16,17,20).
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide?
N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 301.37 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)-4-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 2574102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).