N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide

C25H29N5O3 — CID 167375591

About N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide

N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 167375591) has the molecular formula C25H29N5O3 and a molecular weight of 447.54 g/mol. Its IUPAC name is N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
• PubChem CID: 167375591
• Molecular Formula: C25H29N5O3
• Molecular Weight: 447.54 g/mol
• Exact Mass: 447.23
• IUPAC Name: N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
• SMILES: CC(C)(O)c1cc2nn(C3CCC(CO)CC3)cc2cc1NC(=O)c1cnn2ccccc12
• InChI: InChI=1S/C25H29N5O3/c1-25(2,33)20-12-21-17(14-30(28-21)18-8-6-16(15-31)7-9-18)11-22(20)27-24(32)19-13-26-29-10-4-3-5-23(19)29/h3-5,10-14,16,18,31,33H,6-9,15H2,1-2H3,(H,27,32)
• InChIKey: CEDFOWQDOZHOOH-UHFFFAOYSA-N
• XLogP: 3.89
• TPSA: 104.68 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	447.54
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-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?

The IUPAC name of N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 167375591) is N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide.

What is the SMILES notation for N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?

The canonical SMILES for N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide is CC(C)(O)c1cc2nn(C3CCC(CO)CC3)cc2cc1NC(=O)c1cnn2ccccc12.

What is the InChIKey of N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?

The InChIKey is CEDFOWQDOZHOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N5O3/c1-25(2,33)20-12-21-17(14-30(28-21)18-8-6-16(15-31)7-9-18)11-22(20)27-24(32)19-13-26-29-10-4-3-5-23(19)29/h3-5,10-14,16,18,31,33H,6-9,15H2,1-2H3,(H,27,32).

What are the key properties of N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?

N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 447.54 g/mol, XLogP of 3.89, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[4-(hydroxymethyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 167375591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).