7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide

C22H27N5O4 — CID 18765431

IUPAC7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide
SMILESCOc1nccc(C)c1NC(=O)c1nn(CCN2CCOCC2)c2c(OC)cccc12
InChIInChI=1S/C22H27N5O4/c1-15-7-8-23-22(30-3)18(15)24-21(28)19-16-5-4-6-17(29-2)20(16)27(25-19)10-9-26-11-13-31-14-12-26/h4-8H,9-14H2,1-3H3,(H,24,28)
InChIKeyHYBHAJLFKWFCFQ-UHFFFAOYSA-N
MW425.49 g/mol
LogP2.34
Rot. Bonds7

About 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide

7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide (PubChem CID 18765431) has the molecular formula C22H27N5O4 and a molecular weight of 425.49 g/mol. Its IUPAC name is 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide
PubChem CID18765431
Molecular FormulaC22H27N5O4
Molecular Weight425.49 g/mol
Exact Mass425.21
IUPAC Name7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide
SMILESCOc1nccc(C)c1NC(=O)c1nn(CCN2CCOCC2)c2c(OC)cccc12
InChIInChI=1S/C22H27N5O4/c1-15-7-8-23-22(30-3)18(15)24-21(28)19-16-5-4-6-17(29-2)20(16)27(25-19)10-9-26-11-13-31-14-12-26/h4-8H,9-14H2,1-3H3,(H,24,28)
InChIKeyHYBHAJLFKWFCFQ-UHFFFAOYSA-N
XLogP2.34
TPSA90.74 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.49
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide?
The IUPAC name of 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide (CID 18765431) is 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide.
What is the SMILES notation for 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide?
The canonical SMILES for 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide is COc1nccc(C)c1NC(=O)c1nn(CCN2CCOCC2)c2c(OC)cccc12.
What is the InChIKey of 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide?
The InChIKey is HYBHAJLFKWFCFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N5O4/c1-15-7-8-23-22(30-3)18(15)24-21(28)19-16-5-4-6-17(29-2)20(16)27(25-19)10-9-26-11-13-31-14-12-26/h4-8H,9-14H2,1-3H3,(H,24,28).
What are the key properties of 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide?
7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide has a molecular weight of 425.49 g/mol, XLogP of 2.34, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(2-methoxy-4-methyl-3-pyridinyl)-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide is sourced from PubChem (CID 18765431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).