2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide

C25H33N5O3 — CID 134810188

IUPAC2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide
SMILESCC(C)n1nc(OC(C)(C)C(=O)NCc2ccncc2)c2cc(CN3CCOCC3)ccc21
InChIInChI=1S/C25H33N5O3/c1-18(2)30-22-6-5-20(17-29-11-13-32-14-12-29)15-21(22)23(28-30)33-25(3,4)24(31)27-16-19-7-9-26-10-8-19/h5-10,15,18H,11-14,16-17H2,1-4H3,(H,27,31)
InChIKeyALSZSLHOIIFLQC-UHFFFAOYSA-N
MW451.57 g/mol
LogP3.32
Rot. Bonds8

About 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide

2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide (PubChem CID 134810188) has the molecular formula C25H33N5O3 and a molecular weight of 451.57 g/mol. Its IUPAC name is 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide.

Molecular Properties

Compound Name2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide
PubChem CID134810188
Molecular FormulaC25H33N5O3
Molecular Weight451.57 g/mol
Exact Mass451.26
IUPAC Name2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide
SMILESCC(C)n1nc(OC(C)(C)C(=O)NCc2ccncc2)c2cc(CN3CCOCC3)ccc21
InChIInChI=1S/C25H33N5O3/c1-18(2)30-22-6-5-20(17-29-11-13-32-14-12-29)15-21(22)23(28-30)33-25(3,4)24(31)27-16-19-7-9-26-10-8-19/h5-10,15,18H,11-14,16-17H2,1-4H3,(H,27,31)
InChIKeyALSZSLHOIIFLQC-UHFFFAOYSA-N
XLogP3.32
TPSA81.51 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.57
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide?
The IUPAC name of 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide (CID 134810188) is 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide.
What is the SMILES notation for 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide?
The canonical SMILES for 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide is CC(C)n1nc(OC(C)(C)C(=O)NCc2ccncc2)c2cc(CN3CCOCC3)ccc21.
What is the InChIKey of 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide?
The InChIKey is ALSZSLHOIIFLQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33N5O3/c1-18(2)30-22-6-5-20(17-29-11-13-32-14-12-29)15-21(22)23(28-30)33-25(3,4)24(31)27-16-19-7-9-26-10-8-19/h5-10,15,18H,11-14,16-17H2,1-4H3,(H,27,31).
What are the key properties of 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide?
2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide has a molecular weight of 451.57 g/mol, XLogP of 3.32, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[5-(morpholin-4-ylmethyl)-1-propan-2-ylindazol-3-yl]oxy-N-(pyridin-4-ylmethyl)propanamide is sourced from PubChem (CID 134810188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).