1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one

C25H31N5O2 — CID 123889597

IUPAC1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one
SMILESCC(C(=O)c1n[nH]c2ccc(-c3cncc(CN4CCOCC4)c3)cc12)C1CCNCC1
InChIInChI=1S/C25H31N5O2/c1-17(19-4-6-26-7-5-19)25(31)24-22-13-20(2-3-23(22)28-29-24)21-12-18(14-27-15-21)16-30-8-10-32-11-9-30/h2-3,12-15,17,19,26H,4-11,16H2,1H3,(H,28,29)
InChIKeyNQBPPNCWARMGET-UHFFFAOYSA-N
MW433.56 g/mol
LogP3.28
Rot. Bonds6

About 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one

1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one (PubChem CID 123889597) has the molecular formula C25H31N5O2 and a molecular weight of 433.56 g/mol. Its IUPAC name is 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one.

Molecular Properties

Compound Name1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one
PubChem CID123889597
Molecular FormulaC25H31N5O2
Molecular Weight433.56 g/mol
Exact Mass433.25
IUPAC Name1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one
SMILESCC(C(=O)c1n[nH]c2ccc(-c3cncc(CN4CCOCC4)c3)cc12)C1CCNCC1
InChIInChI=1S/C25H31N5O2/c1-17(19-4-6-26-7-5-19)25(31)24-22-13-20(2-3-23(22)28-29-24)21-12-18(14-27-15-21)16-30-8-10-32-11-9-30/h2-3,12-15,17,19,26H,4-11,16H2,1H3,(H,28,29)
InChIKeyNQBPPNCWARMGET-UHFFFAOYSA-N
XLogP3.28
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.56
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one with MolForge

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

Launch Full Analysis

Related Compounds

N-[1-(2-methylpropyl)piperidin-4-yl]-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381758
3-cyclopentyl-1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]propan-1-one
CID 123403005
N-cyclohexyl-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382016
N-(6-amino-5-methyl-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 123275333
5-[5-(azepan-1-ylmethyl)-3-pyridinyl]-N-(oxan-4-yl)-1H-indazole-3-carboxamide
CID 118381641
N-[6-(azetidin-1-yl)-3-pyridinyl]-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89450813
N-(1-but-2-ynylpiperidin-4-yl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381343
N-(3-fluorophenyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89459049
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89451050
5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-N-[3-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide
CID 89458744
N-(6-morpholin-4-yl-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89451187
N-[4-[(dimethylamino)methyl]phenyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[4-(morpholin-4-ylmethyl)phenyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[4-(piperidin-1-ylmethyl)phenyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-[4-(pyrrolidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide
CID 160681603

Frequently Asked Questions

What is the IUPAC name of 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one?
The IUPAC name of 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one (CID 123889597) is 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one.
What is the SMILES notation for 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one?
The canonical SMILES for 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one is CC(C(=O)c1n[nH]c2ccc(-c3cncc(CN4CCOCC4)c3)cc12)C1CCNCC1.
What is the InChIKey of 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one?
The InChIKey is NQBPPNCWARMGET-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H31N5O2/c1-17(19-4-6-26-7-5-19)25(31)24-22-13-20(2-3-23(22)28-29-24)21-12-18(14-27-15-21)16-30-8-10-32-11-9-30/h2-3,12-15,17,19,26H,4-11,16H2,1H3,(H,28,29).
What are the key properties of 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one?
1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one has a molecular weight of 433.56 g/mol, XLogP of 3.28, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-2-piperidin-4-ylpropan-1-one is sourced from PubChem (CID 123889597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).