2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide

C78H105N15O12 — CID 163573075

IUPAC2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide
SMILESC[C@@H]1CN(c2cccc(NC(=O)c3ccc(C(C)(O)CO)nc3N3CCC4(CC3)CC4)n2)CCO1.C[C@@H]1CN(c2cccc(NC(=O)c3ccc([C@@](C)(O)CO)nc3N3CCC4(CC3)CC4)n2)CCO1.C[C@@H]1CN(c2cccc(NC(=O)c3ccc([C@](C)(O)CO)nc3N3CCC4(CC3)CC4)n2)CCO1
InChIInChI=1S/3C26H35N5O4/c3*1-18-16-31(14-15-35-18)22-5-3-4-21(28-22)29-24(33)19-6-7-20(25(2,34)17-32)27-23(19)30-12-10-26(8-9-26)11-13-30/h3*3-7,18,32,34H,8-17H2,1-2H3,(H,28,29,33)/t18-,25?;18-,25+;18-,25-/m111/s1
InChIKeyGBBGPOAACBCWSS-ACAXYHBASA-N
MW1444.79 g/mol
LogP7.60
Rot. Bonds18

About 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide

2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide (PubChem CID 163573075) has the molecular formula C78H105N15O12 and a molecular weight of 1444.79 g/mol. Its IUPAC name is 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide
PubChem CID163573075
Molecular FormulaC78H105N15O12
Molecular Weight1444.79 g/mol
Exact Mass1443.81
IUPAC Name2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide
SMILESC[C@@H]1CN(c2cccc(NC(=O)c3ccc(C(C)(O)CO)nc3N3CCC4(CC3)CC4)n2)CCO1.C[C@@H]1CN(c2cccc(NC(=O)c3ccc([C@@](C)(O)CO)nc3N3CCC4(CC3)CC4)n2)CCO1.C[C@@H]1CN(c2cccc(NC(=O)c3ccc([C@](C)(O)CO)nc3N3CCC4(CC3)CC4)n2)CCO1
InChIInChI=1S/3C26H35N5O4/c3*1-18-16-31(14-15-35-18)22-5-3-4-21(28-22)29-24(33)19-6-7-20(25(2,34)17-32)27-23(19)30-12-10-26(8-9-26)11-13-30/h3*3-7,18,32,34H,8-17H2,1-2H3,(H,28,29,33)/t18-,25?;18-,25+;18-,25-/m111/s1
InChIKeyGBBGPOAACBCWSS-ACAXYHBASA-N
XLogP7.60
TPSA333.15 Ų
H-Bond Donors9
H-Bond Acceptors24
Rotatable Bonds18
Heavy Atoms105
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001444.79
LogP ≤ 57.60
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1024

Analyze 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide (CID 163573075) is 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide is C[C@@H]1CN(c2cccc(NC(=O)c3ccc(C(C)(O)CO)nc3N3CCC4(CC3)CC4)n2)CCO1.C[C@@H]1CN(c2cccc(NC(=O)c3ccc([C@@](C)(O)CO)nc3N3CCC4(CC3)CC4)n2)CCO1.C[C@@H]1CN(c2cccc(NC(=O)c3ccc([C@](C)(O)CO)nc3N3CCC4(CC3)CC4)n2)CCO1.
What is the InChIKey of 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide?
The InChIKey is GBBGPOAACBCWSS-ACAXYHBASA-N. The full InChI is InChI=1S/3C26H35N5O4/c3*1-18-16-31(14-15-35-18)22-5-3-4-21(28-22)29-24(33)19-6-7-20(25(2,34)17-32)27-23(19)30-12-10-26(8-9-26)11-13-30/h3*3-7,18,32,34H,8-17H2,1-2H3,(H,28,29,33)/t18-,25?;18-,25+;18-,25-/m111/s1.
What are the key properties of 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide?
2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide has a molecular weight of 1444.79 g/mol, XLogP of 7.60, 18 rotatable bonds, 9 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-azaspiro[2.5]octan-6-yl)-6-(1,2-dihydroxypropan-2-yl)-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2R)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide;2-(6-azaspiro[2.5]octan-6-yl)-6-[(2S)-1,2-dihydroxypropan-2-yl]-N-[6-[(2R)-2-methylmorpholin-4-yl]-2-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 163573075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).