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

C30H36N4O5 — CID 130229535

About 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

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 (PubChem CID 130229535) has the molecular formula C30H36N4O5 and a molecular weight of 532.64 g/mol. Its IUPAC name is 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.

Molecular Properties

• Compound Name: 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
• PubChem CID: 130229535
• Molecular Formula: C30H36N4O5
• Molecular Weight: 532.64 g/mol
• Exact Mass: 532.27
• IUPAC Name: 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
• SMILES: Cc1ccc(OC2CC3(CC(NC(=O)c4cnn5c(C6CC6)c(OCC(C)(C)O)ccc45)C3)C2)c(C(N)=O)c1
• InChI: InChI=1S/C30H36N4O5/c1-17-4-8-24(21(10-17)27(31)35)39-20-13-30(14-20)11-19(12-30)33-28(36)22-15-32-34-23(22)7-9-25(26(34)18-5-6-18)38-16-29(2,3)37/h4,7-10,15,18-20,37H,5-6,11-14,16H2,1-3H3,(H2,31,35)(H,33,36)
• InChIKey: CJVDGBGDAPZSSW-UHFFFAOYSA-N
• XLogP: 3.89
• TPSA: 128.18 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 7
• Rotatable Bonds: 9
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	532.64
LogP ≤ 5	3.89
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 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?

The IUPAC name of 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) is 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.

What is the SMILES notation for 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?

The canonical SMILES for 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 is Cc1ccc(OC2CC3(CC(NC(=O)c4cnn5c(C6CC6)c(OCC(C)(C)O)ccc45)C3)C2)c(C(N)=O)c1.

What is the InChIKey of 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?

The InChIKey is CJVDGBGDAPZSSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H36N4O5/c1-17-4-8-24(21(10-17)27(31)35)39-20-13-30(14-20)11-19(12-30)33-28(36)22-15-32-34-23(22)7-9-25(26(34)18-5-6-18)38-16-29(2,3)37/h4,7-10,15,18-20,37H,5-6,11-14,16H2,1-3H3,(H2,31,35)(H,33,36).

What are the key properties of 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?

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 has a molecular weight of 532.64 g/mol, XLogP of 3.89, 9 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 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 is sourced from PubChem (CID 130229535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).