N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide

C15H15N3O2S — CID 166234118

IUPACN-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide
SMILESCC(=O)N1CCc2cccc(NC(=O)c3csc(C)n3)c21
InChIInChI=1S/C15H15N3O2S/c1-9-16-13(8-21-9)15(20)17-12-5-3-4-11-6-7-18(10(2)19)14(11)12/h3-5,8H,6-7H2,1-2H3,(H,17,20)
InChIKeyQKPBYYNQORYFRJ-UHFFFAOYSA-N
MW301.37 g/mol
LogP2.61
Rot. Bonds2

About N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide

N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide (PubChem CID 166234118) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide
PubChem CID166234118
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC NameN-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide
SMILESCC(=O)N1CCc2cccc(NC(=O)c3csc(C)n3)c21
InChIInChI=1S/C15H15N3O2S/c1-9-16-13(8-21-9)15(20)17-12-5-3-4-11-6-7-18(10(2)19)14(11)12/h3-5,8H,6-7H2,1-2H3,(H,17,20)
InChIKeyQKPBYYNQORYFRJ-UHFFFAOYSA-N
XLogP2.61
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-acetyl-2,3-dihydroindol-7-yl)-4-bromobenzamide
CID 112537123
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methylpropanamide
CID 112537152
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide
CID 112537144
N-(2,3-difluorophenyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 47450900
1-(1-acetyl-2,3-dihydroindol-7-yl)-3-(2,4-difluorophenyl)urea
CID 3415037
N-(1-acetyl-2,3-dihydroindol-7-yl)-3-pyridin-4-ylpropanamide
CID 112537187
N-(1H-indazol-4-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 110474099
2-[2-[(2-methyl-1,3-thiazole-4-carbonyl)amino]phenyl]acetic acid
CID 65199403
N-(1-acetyl-2,3-dihydroindol-7-yl)-3-(4-methoxyphenyl)propanamide
CID 112537172
4-[(2-bromo-3-methylphenyl)carbamoyl]-1,3-thiazole-2-carboxylic acid
CID 104892937
N-(1-acetyl-2,3-dihydroindol-7-yl)-3-morpholin-4-ylpropanamide
CID 112537116
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(3-methoxyphenyl)acetamide
CID 112537141

Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide (CID 166234118) is N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide is CC(=O)N1CCc2cccc(NC(=O)c3csc(C)n3)c21.
What is the InChIKey of N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide?
The InChIKey is QKPBYYNQORYFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-9-16-13(8-21-9)15(20)17-12-5-3-4-11-6-7-18(10(2)19)14(11)12/h3-5,8H,6-7H2,1-2H3,(H,17,20).
What are the key properties of N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide?
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide has a molecular weight of 301.37 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 166234118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).