N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide

C24H28N6O5 — CID 130229954

IUPACN-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCC(C)(O)COc1ccc2c(C(=O)NC3CC4(C3)CC(Oc3nccnc3C(N)=O)C4)cnn2c1
InChIInChI=1S/C24H28N6O5/c1-23(2,33)13-34-15-3-4-18-17(11-28-30(18)12-15)21(32)29-14-7-24(8-14)9-16(10-24)35-22-19(20(25)31)26-5-6-27-22/h3-6,11-12,14,16,33H,7-10,13H2,1-2H3,(H2,25,31)(H,29,32)
InChIKeyBEJLLLKDLSBZID-UHFFFAOYSA-N
MW480.53 g/mol
LogP1.49
Rot. Bonds8

About N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide

N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 130229954) has the molecular formula C24H28N6O5 and a molecular weight of 480.53 g/mol. Its IUPAC name is N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID130229954
Molecular FormulaC24H28N6O5
Molecular Weight480.53 g/mol
Exact Mass480.21
IUPAC NameN-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCC(C)(O)COc1ccc2c(C(=O)NC3CC4(C3)CC(Oc3nccnc3C(N)=O)C4)cnn2c1
InChIInChI=1S/C24H28N6O5/c1-23(2,33)13-34-15-3-4-18-17(11-28-30(18)12-15)21(32)29-14-7-24(8-14)9-16(10-24)35-22-19(20(25)31)26-5-6-27-22/h3-6,11-12,14,16,33H,7-10,13H2,1-2H3,(H2,25,31)(H,29,32)
InChIKeyBEJLLLKDLSBZID-UHFFFAOYSA-N
XLogP1.49
TPSA153.96 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500480.53
LogP ≤ 51.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

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Related Compounds

N-[2-(2-carbamoyl-4-methoxyphenoxy)spiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 130229562
N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 137413326
N-[2-[(3-carbamoyl-2-pyridinyl)oxy]spiro[3.3]heptan-6-yl]-6-[(2R)-2-hydroxypropoxy]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 156699722
6-(2-hydroxy-2-methylpropoxy)-N-[2-[4-(3-methoxyphenyl)phenoxy]spiro[3.3]heptan-6-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 130230247
N-[2-[2-carbamoyl-5-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]spiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 130229737
N-[2-[2-carbamoyl-5-(6-fluoro-2-pyridinyl)phenoxy]spiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 130230238
N-[2-[(3-carbamoyl-2-pyridinyl)oxy]spiro[3.3]heptan-6-yl]-6-[2-(dimethylamino)ethoxy]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 157022093
6-(2-hydroxy-2-methylpropoxy)-N-[2-[4-[3-(methoxymethyl)phenyl]phenoxy]spiro[3.3]heptan-6-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 130229068
N-[4-(2-carbamoyl-5-hydroxyphenoxy)cyclohexyl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 137413287
N-[4-(2-carbamoyl-5-pyrimidin-2-ylphenoxy)cyclohexyl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 137413516
7-cyclopropyl-6-(2-hydroxy-2-methylpropoxy)-N-[2-(4-methoxyphenoxy)spiro[3.3]heptan-6-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 137406313
N-[2-(2-carbamoyl-4-methylphenoxy)spiro[3.3]heptan-6-yl]-7-cyclopropyl-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 130229535

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide (CID 130229954) is N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide is CC(C)(O)COc1ccc2c(C(=O)NC3CC4(C3)CC(Oc3nccnc3C(N)=O)C4)cnn2c1.
What is the InChIKey of N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is BEJLLLKDLSBZID-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N6O5/c1-23(2,33)13-34-15-3-4-18-17(11-28-30(18)12-15)21(32)29-14-7-24(8-14)9-16(10-24)35-22-19(20(25)31)26-5-6-27-22/h3-6,11-12,14,16,33H,7-10,13H2,1-2H3,(H2,25,31)(H,29,32).
What are the key properties of N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide?
N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 480.53 g/mol, XLogP of 1.49, 8 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-carbamoylpyrazin-2-yl)oxyspiro[3.3]heptan-6-yl]-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 130229954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).