N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide

C15H15N3OS — CID 60679000

IUPACN-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide
SMILESCC(C)c1csc(NC(=O)c2c[nH]c3ccccc23)n1
InChIInChI=1S/C15H15N3OS/c1-9(2)13-8-20-15(17-13)18-14(19)11-7-16-12-6-4-3-5-10(11)12/h3-9,16H,1-2H3,(H,17,18,19)
InChIKeyMNOCEJNFXHOETI-UHFFFAOYSA-N
MW285.37 g/mol
LogP4.00
Rot. Bonds3

About N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide

N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide (PubChem CID 60679000) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide
PubChem CID60679000
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC NameN-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide
SMILESCC(C)c1csc(NC(=O)c2c[nH]c3ccccc23)n1
InChIInChI=1S/C15H15N3OS/c1-9(2)13-8-20-15(17-13)18-14(19)11-7-16-12-6-4-3-5-10(11)12/h3-9,16H,1-2H3,(H,17,18,19)
InChIKeyMNOCEJNFXHOETI-UHFFFAOYSA-N
XLogP4.00
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1H-indol-3-yl-(4-propan-2-yl-1,3-thiazol-2-yl)methanone;sulfur trioxide
CID 160595335
N-(4-propan-2-yl-1,3-thiazol-2-yl)-2-(propylamino)benzamide
CID 62174910
2,3-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 37019052
N-[4-(1-aminoethyl)-1,3-thiazol-2-yl]naphthalene-1-carboxamide
CID 64558447
2-amino-3-fluoro-N-(4-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 62661911
5-[(4-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]thiophene-2-carboxylic acid
CID 60721950
N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-1H-indole-3-carboxamide
CID 43989177
N-(4-methylpentan-2-yl)-1H-indole-3-carboxamide
CID 43582090
N-butan-2-yl-1H-indole-3-carboxamide
CID 43399203
N-(4-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 46674310
2-chloro-N-(4-propan-2-yl-1,3-thiazol-2-yl)-5-sulfanylbenzamide
CID 107025323
N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-benzothiazole-2-carboxamide
CID 30715657

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide?
The IUPAC name of N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide (CID 60679000) is N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide.
What is the SMILES notation for N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide?
The canonical SMILES for N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide is CC(C)c1csc(NC(=O)c2c[nH]c3ccccc23)n1.
What is the InChIKey of N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide?
The InChIKey is MNOCEJNFXHOETI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-9(2)13-8-20-15(17-13)18-14(19)11-7-16-12-6-4-3-5-10(11)12/h3-9,16H,1-2H3,(H,17,18,19).
What are the key properties of N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide?
N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide has a molecular weight of 285.37 g/mol, XLogP of 4.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-indole-3-carboxamide is sourced from PubChem (CID 60679000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).