5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide

C16H16Cl2N4OS — CID 172813011

IUPAC5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide
SMILESCN1CCC2(C1)CN(C(=O)Nc1ncc(Cl)s1)c1ccc(Cl)cc12
InChIInChI=1S/C16H16Cl2N4OS/c1-21-5-4-16(8-21)9-22(12-3-2-10(17)6-11(12)16)15(23)20-14-19-7-13(18)24-14/h2-3,6-7H,4-5,8-9H2,1H3,(H,19,20,23)
InChIKeySLBRESVKOPINNJ-UHFFFAOYSA-N
MW383.30 g/mol
LogP4.08
Rot. Bonds1

About 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide

5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide (PubChem CID 172813011) has the molecular formula C16H16Cl2N4OS and a molecular weight of 383.30 g/mol. Its IUPAC name is 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide
PubChem CID172813011
Molecular FormulaC16H16Cl2N4OS
Molecular Weight383.30 g/mol
Exact Mass382.04
IUPAC Name5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide
SMILESCN1CCC2(C1)CN(C(=O)Nc1ncc(Cl)s1)c1ccc(Cl)cc12
InChIInChI=1S/C16H16Cl2N4OS/c1-21-5-4-16(8-21)9-22(12-3-2-10(17)6-11(12)16)15(23)20-14-19-7-13(18)24-14/h2-3,6-7H,4-5,8-9H2,1H3,(H,19,20,23)
InChIKeySLBRESVKOPINNJ-UHFFFAOYSA-N
XLogP4.08
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.30
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-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

5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-[2-(dimethylamino)-2-oxoacetyl]spiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide
CID 90449858
5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-[2-(methylamino)-2-oxoacetyl]spiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide
CID 71523047
5-chloro-1-N-(5-chloro-1,3-thiazol-2-yl)-1-N'-(2-hydroxyethyl)spiro[2H-indole-3,3'-pyrrolidine]-1,1'-dicarboxamide
CID 90449563
methyl 2-[5-chloro-1-[(5-chloro-1,3-thiazol-2-yl)carbamoyl]spiro[2H-indole-3,3'-pyrrolidine]-1'-yl]acetate
CID 90449729
3-[[[5-chloro-1-[(5-chloro-1,3-thiazol-2-yl)carbamoyl]spiro[2H-indole-3,3'-pyrrolidine]-1'-carbonyl]amino]methyl]azetidine-1-carboxylic acid
CID 90449728
5-bromo-N-(5-chloro-1,3-thiazol-2-yl)-1'-ethylsulfonylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide
CID 90449413
methyl 5-chloro-1-[[5-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]carbamoyl]spiro[2H-indole-3,3'-pyrrolidine]-1'-carboxylate
CID 90449925
ethyl 2-[(5-chloro-1'-methoxycarbonylspiro[2H-indole-3,3'-pyrrolidine]-1-carbonyl)amino]-1,3-thiazole-5-carboxylate
CID 90449625
1-(1'-acetyl-5-chlorospiro[2H-indole-3,3'-pyrrolidine]-1-yl)-2-(5-chloro-1,3-thiazol-2-yl)ethanone
CID 149388037
1'-acetyl-N-(5-chloro-1,3-thiazol-2-yl)-5-(2-methoxyethylsulfamoyl)spiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide
CID 90449579
methyl 3-[[2-[(1'-acetyl-5-chlorospiro[2H-indole-3,3'-pyrrolidine]-1-carbonyl)amino]-1,3-thiazol-5-yl]oxy]benzoate
CID 90449266
5-[4-(azetidin-1-yl)-4-oxobutyl]-1-N-(5-chloro-1,3-thiazol-2-yl)-1-N'-methylspiro[2H-indole-3,3'-pyrrolidine]-1,1'-dicarboxamide
CID 90449396

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide?
The IUPAC name of 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide (CID 172813011) is 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide.
What is the SMILES notation for 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide?
The canonical SMILES for 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide is CN1CCC2(C1)CN(C(=O)Nc1ncc(Cl)s1)c1ccc(Cl)cc12.
What is the InChIKey of 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide?
The InChIKey is SLBRESVKOPINNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N4OS/c1-21-5-4-16(8-21)9-22(12-3-2-10(17)6-11(12)16)15(23)20-14-19-7-13(18)24-14/h2-3,6-7H,4-5,8-9H2,1H3,(H,19,20,23).
What are the key properties of 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide?
5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide has a molecular weight of 383.30 g/mol, XLogP of 4.08, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(5-chloro-1,3-thiazol-2-yl)-1'-methylspiro[2H-indole-3,3'-pyrrolidine]-1-carboxamide is sourced from PubChem (CID 172813011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).