(6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide

C21H26N6O2 — CID 162481512

IUPAC(6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide
SMILESC[C@@H]1CN(c2ccc(C#N)n3nccc23)CC(C(=O)NC2CN(C)CC23CC3)O1
InChIInChI=1S/C21H26N6O2/c1-14-10-26(16-4-3-15(9-22)27-17(16)5-8-23-27)11-18(29-14)20(28)24-19-12-25(2)13-21(19)6-7-21/h3-5,8,14,18-19H,6-7,10-13H2,1-2H3,(H,24,28)/t14-,18?,19?/m1/s1
InChIKeyIJOMWHGKBZDDFE-FTXHTYHOSA-N
MW394.48 g/mol
LogP1.01
Rot. Bonds3

About (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide

(6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide (PubChem CID 162481512) has the molecular formula C21H26N6O2 and a molecular weight of 394.48 g/mol. Its IUPAC name is (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide.

Molecular Properties

Compound Name(6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide
PubChem CID162481512
Molecular FormulaC21H26N6O2
Molecular Weight394.48 g/mol
Exact Mass394.21
IUPAC Name(6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide
SMILESC[C@@H]1CN(c2ccc(C#N)n3nccc23)CC(C(=O)NC2CN(C)CC23CC3)O1
InChIInChI=1S/C21H26N6O2/c1-14-10-26(16-4-3-15(9-22)27-17(16)5-8-23-27)11-18(29-14)20(28)24-19-12-25(2)13-21(19)6-7-21/h3-5,8,14,18-19H,6-7,10-13H2,1-2H3,(H,24,28)/t14-,18?,19?/m1/s1
InChIKeyIJOMWHGKBZDDFE-FTXHTYHOSA-N
XLogP1.01
TPSA85.90 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.48
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-pyridin-4-ylmorpholine-2-carboxamide
CID 175445876
4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)-6-methylmorpholine-2-carboxamide
CID 175445858
4-[(2S,6R)-2-(2,7-diazaspiro[3.5]nonan-2-ylmethyl)-6-methylmorpholin-4-yl]pyrazolo[1,5-a]pyridine-7-carbonitrile
CID 146443983
6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide
CID 175870903
benzyl N-(9-azabicyclo[3.3.1]nonan-3-yl)carbamate;tert-butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate;(2R,6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)morpholine-2-carboxamide;9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 163809786
4-[(2S,6R)-2-(3,9-diazaspiro[5.5]undecan-3-ylmethyl)-6-methylmorpholin-4-yl]pyrazolo[1,5-a]pyridine-7-carbonitrile
CID 146444031
4-[(2R,6S)-2-methyl-6-[[4-(4-methylpiperazin-1-yl)piperidin-1-yl]methyl]morpholin-4-yl]pyrazolo[1,5-a]pyridine-7-carbonitrile
CID 146444070
tert-butyl 4-[4-[[[(2S,6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methylmorpholin-2-yl]methylamino]methyl]phenyl]piperazine-1-carboxylate
CID 146443011
4-[(3S,5S)-3-[(3S)-3-amino-2-oxobutyl]-5-methylpiperidin-1-yl]pyrazolo[1,5-a]pyridine-7-carbonitrile
CID 163463321
2-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-4-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine-8-carboxylic acid;2,2-dimethylbutane
CID 155708037
4-[(2S,6R)-2-(3,7-diazabicyclo[4.2.0]octan-3-ylmethyl)-6-methylmorpholin-4-yl]pyrazolo[1,5-a]pyridine-7-carbonitrile
CID 146443996
4-[(2R,6S)-2-methyl-6-[(4-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)methyl]morpholin-4-yl]pyrazolo[1,5-a]pyridine-7-carbonitrile
CID 166995273

Frequently Asked Questions

What is the IUPAC name of (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide?
The IUPAC name of (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide (CID 162481512) is (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide.
What is the SMILES notation for (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide?
The canonical SMILES for (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide is C[C@@H]1CN(c2ccc(C#N)n3nccc23)CC(C(=O)NC2CN(C)CC23CC3)O1.
What is the InChIKey of (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide?
The InChIKey is IJOMWHGKBZDDFE-FTXHTYHOSA-N. The full InChI is InChI=1S/C21H26N6O2/c1-14-10-26(16-4-3-15(9-22)27-17(16)5-8-23-27)11-18(29-14)20(28)24-19-12-25(2)13-21(19)6-7-21/h3-5,8,14,18-19H,6-7,10-13H2,1-2H3,(H,24,28)/t14-,18?,19?/m1/s1.
What are the key properties of (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide?
(6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide has a molecular weight of 394.48 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-4-(7-cyanopyrazolo[1,5-a]pyridin-4-yl)-6-methyl-N-(5-methyl-5-azaspiro[2.4]heptan-7-yl)morpholine-2-carboxamide is sourced from PubChem (CID 162481512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).