6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide

C17H15N5O2S — CID 154876323

IUPAC6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide
SMILESCOc1ccc2cc(C(=O)Nc3cn[nH]c3-c3nccs3)n(C)c2c1
InChIInChI=1S/C17H15N5O2S/c1-22-13-8-11(24-2)4-3-10(13)7-14(22)16(23)20-12-9-19-21-15(12)17-18-5-6-25-17/h3-9H,1-2H3,(H,19,21)(H,20,23)
InChIKeyXWYGTXOPEUPROY-UHFFFAOYSA-N
MW353.41 g/mol
LogP3.29
Rot. Bonds4

About 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide

6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide (PubChem CID 154876323) has the molecular formula C17H15N5O2S and a molecular weight of 353.41 g/mol. Its IUPAC name is 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide.

Molecular Properties

Compound Name6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide
PubChem CID154876323
Molecular FormulaC17H15N5O2S
Molecular Weight353.41 g/mol
Exact Mass353.09
IUPAC Name6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide
SMILESCOc1ccc2cc(C(=O)Nc3cn[nH]c3-c3nccs3)n(C)c2c1
InChIInChI=1S/C17H15N5O2S/c1-22-13-8-11(24-2)4-3-10(13)7-14(22)16(23)20-12-9-19-21-15(12)17-18-5-6-25-17/h3-9H,1-2H3,(H,19,21)(H,20,23)
InChIKeyXWYGTXOPEUPROY-UHFFFAOYSA-N
XLogP3.29
TPSA84.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.41
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide?
The IUPAC name of 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide (CID 154876323) is 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide.
What is the SMILES notation for 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide?
The canonical SMILES for 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide is COc1ccc2cc(C(=O)Nc3cn[nH]c3-c3nccs3)n(C)c2c1.
What is the InChIKey of 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide?
The InChIKey is XWYGTXOPEUPROY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2S/c1-22-13-8-11(24-2)4-3-10(13)7-14(22)16(23)20-12-9-19-21-15(12)17-18-5-6-25-17/h3-9H,1-2H3,(H,19,21)(H,20,23).
What are the key properties of 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide?
6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide has a molecular weight of 353.41 g/mol, XLogP of 3.29, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1-methyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]indole-2-carboxamide is sourced from PubChem (CID 154876323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).