1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide

C20H24N6O — CID 171491963

IUPAC1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide
SMILESCc1ccc(NC(=O)c2ccc3c(cnn3C)c2)nc1N1CCN(C)CC1
InChIInChI=1S/C20H24N6O/c1-14-4-7-18(22-19(14)26-10-8-24(2)9-11-26)23-20(27)15-5-6-17-16(12-15)13-21-25(17)3/h4-7,12-13H,8-11H2,1-3H3,(H,22,23,27)
InChIKeyZQRNZKXQKGFQSN-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.28
Rot. Bonds3

About 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide

1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide (PubChem CID 171491963) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide
PubChem CID171491963
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC Name1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide
SMILESCc1ccc(NC(=O)c2ccc3c(cnn3C)c2)nc1N1CCN(C)CC1
InChIInChI=1S/C20H24N6O/c1-14-4-7-18(22-19(14)26-10-8-24(2)9-11-26)23-20(27)15-5-6-17-16(12-15)13-21-25(17)3/h4-7,12-13H,8-11H2,1-3H3,(H,22,23,27)
InChIKeyZQRNZKXQKGFQSN-UHFFFAOYSA-N
XLogP2.28
TPSA66.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide?
The IUPAC name of 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide (CID 171491963) is 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide.
What is the SMILES notation for 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide?
The canonical SMILES for 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide is Cc1ccc(NC(=O)c2ccc3c(cnn3C)c2)nc1N1CCN(C)CC1.
What is the InChIKey of 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide?
The InChIKey is ZQRNZKXQKGFQSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-14-4-7-18(22-19(14)26-10-8-24(2)9-11-26)23-20(27)15-5-6-17-16(12-15)13-21-25(17)3/h4-7,12-13H,8-11H2,1-3H3,(H,22,23,27).
What are the key properties of 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide?
1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[5-methyl-6-(4-methylpiperazin-1-yl)-2-pyridinyl]indazole-5-carboxamide is sourced from PubChem (CID 171491963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).