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

C24H30N4O3 — CID 18765265

IUPAC7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide
SMILESCCC(NC(=O)c1nn(CCN2CCOCC2)c2c(OC)cccc12)c1ccccc1
InChIInChI=1S/C24H30N4O3/c1-3-20(18-8-5-4-6-9-18)25-24(29)22-19-10-7-11-21(30-2)23(19)28(26-22)13-12-27-14-16-31-17-15-27/h4-11,20H,3,12-17H2,1-2H3,(H,25,29)
InChIKeyJDLIJEBLUBDTTE-UHFFFAOYSA-N
MW422.53 g/mol
LogP3.26
Rot. Bonds8

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

7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide (PubChem CID 18765265) has the molecular formula C24H30N4O3 and a molecular weight of 422.53 g/mol. Its IUPAC name is 7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide
PubChem CID18765265
Molecular FormulaC24H30N4O3
Molecular Weight422.53 g/mol
Exact Mass422.23
IUPAC Name7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide
SMILESCCC(NC(=O)c1nn(CCN2CCOCC2)c2c(OC)cccc12)c1ccccc1
InChIInChI=1S/C24H30N4O3/c1-3-20(18-8-5-4-6-9-18)25-24(29)22-19-10-7-11-21(30-2)23(19)28(26-22)13-12-27-14-16-31-17-15-27/h4-11,20H,3,12-17H2,1-2H3,(H,25,29)
InChIKeyJDLIJEBLUBDTTE-UHFFFAOYSA-N
XLogP3.26
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide?
The IUPAC name of 7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide (CID 18765265) is 7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide.
What is the SMILES notation for 7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide?
The canonical SMILES for 7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide is CCC(NC(=O)c1nn(CCN2CCOCC2)c2c(OC)cccc12)c1ccccc1.
What is the InChIKey of 7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide?
The InChIKey is JDLIJEBLUBDTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O3/c1-3-20(18-8-5-4-6-9-18)25-24(29)22-19-10-7-11-21(30-2)23(19)28(26-22)13-12-27-14-16-31-17-15-27/h4-11,20H,3,12-17H2,1-2H3,(H,25,29).
What are the key properties of 7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide?
7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide has a molecular weight of 422.53 g/mol, XLogP of 3.26, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1-(2-morpholin-4-ylethyl)-N-(1-phenylpropyl)indazole-3-carboxamide is sourced from PubChem (CID 18765265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).