N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C17H15N5O2 — CID 58056166

IUPACN-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCOc1cc2cc(C)[nH]c2cc1NC(=O)c1cnn2cccnc12
InChIInChI=1S/C17H15N5O2/c1-10-6-11-7-15(24-2)14(8-13(11)20-10)21-17(23)12-9-19-22-5-3-4-18-16(12)22/h3-9,20H,1-2H3,(H,21,23)
InChIKeyAMAGSYXNXRTPKB-UHFFFAOYSA-N
MW321.34 g/mol
LogP2.78
Rot. Bonds3

About N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 58056166) has the molecular formula C17H15N5O2 and a molecular weight of 321.34 g/mol. Its IUPAC name is N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID58056166
Molecular FormulaC17H15N5O2
Molecular Weight321.34 g/mol
Exact Mass321.12
IUPAC NameN-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCOc1cc2cc(C)[nH]c2cc1NC(=O)c1cnn2cccnc12
InChIInChI=1S/C17H15N5O2/c1-10-6-11-7-15(24-2)14(8-13(11)20-10)21-17(23)12-9-19-22-5-3-4-18-16(12)22/h3-9,20H,1-2H3,(H,21,23)
InChIKeyAMAGSYXNXRTPKB-UHFFFAOYSA-N
XLogP2.78
TPSA84.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 58056166) is N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is COc1cc2cc(C)[nH]c2cc1NC(=O)c1cnn2cccnc12.
What is the InChIKey of N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is AMAGSYXNXRTPKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O2/c1-10-6-11-7-15(24-2)14(8-13(11)20-10)21-17(23)12-9-19-22-5-3-4-18-16(12)22/h3-9,20H,1-2H3,(H,21,23).
What are the key properties of N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 321.34 g/mol, XLogP of 2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methoxy-2-methyl-1H-indol-6-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 58056166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).