7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide

C23H28N4O4 — CID 10159384

IUPAC7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide
SMILESCOc1ccccc1CNC(=O)c1nn(CCN2CCOCC2)c2c(OC)cccc12
InChIInChI=1S/C23H28N4O4/c1-29-19-8-4-3-6-17(19)16-24-23(28)21-18-7-5-9-20(30-2)22(18)27(25-21)11-10-26-12-14-31-15-13-26/h3-9H,10-16H2,1-2H3,(H,24,28)
InChIKeyOMRMTIYZBXTTOP-UHFFFAOYSA-N
MW424.50 g/mol
LogP2.32
Rot. Bonds8

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

7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide (PubChem CID 10159384) has the molecular formula C23H28N4O4 and a molecular weight of 424.50 g/mol. Its IUPAC name is 7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide
PubChem CID10159384
Molecular FormulaC23H28N4O4
Molecular Weight424.50 g/mol
Exact Mass424.21
IUPAC Name7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide
SMILESCOc1ccccc1CNC(=O)c1nn(CCN2CCOCC2)c2c(OC)cccc12
InChIInChI=1S/C23H28N4O4/c1-29-19-8-4-3-6-17(19)16-24-23(28)21-18-7-5-9-20(30-2)22(18)27(25-21)11-10-26-12-14-31-15-13-26/h3-9H,10-16H2,1-2H3,(H,24,28)
InChIKeyOMRMTIYZBXTTOP-UHFFFAOYSA-N
XLogP2.32
TPSA77.85 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.50
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide?
The IUPAC name of 7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide (CID 10159384) is 7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide.
What is the SMILES notation for 7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide?
The canonical SMILES for 7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide is COc1ccccc1CNC(=O)c1nn(CCN2CCOCC2)c2c(OC)cccc12.
What is the InChIKey of 7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide?
The InChIKey is OMRMTIYZBXTTOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O4/c1-29-19-8-4-3-6-17(19)16-24-23(28)21-18-7-5-9-20(30-2)22(18)27(25-21)11-10-26-12-14-31-15-13-26/h3-9H,10-16H2,1-2H3,(H,24,28).
What are the key properties of 7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide?
7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide has a molecular weight of 424.50 g/mol, XLogP of 2.32, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-[(2-methoxyphenyl)methyl]-1-(2-morpholin-4-ylethyl)indazole-3-carboxamide is sourced from PubChem (CID 10159384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).