N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide

C25H29N5O5 — CID 130248299

IUPACN-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1OC1CCC(NC(=O)c2cnn3cc(OC4CCOCC4)ccc23)CC1
InChIInChI=1S/C25H29N5O5/c26-23(31)20-2-1-11-27-25(20)35-17-5-3-16(4-6-17)29-24(32)21-14-28-30-15-19(7-8-22(21)30)34-18-9-12-33-13-10-18/h1-2,7-8,11,14-18H,3-6,9-10,12-13H2,(H2,26,31)(H,29,32)
InChIKeyFFLNTSKZLHXIAF-UHFFFAOYSA-N
MW479.54 g/mol
LogP2.51
Rot. Bonds7

About N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide

N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 130248299) has the molecular formula C25H29N5O5 and a molecular weight of 479.54 g/mol. Its IUPAC name is N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID130248299
Molecular FormulaC25H29N5O5
Molecular Weight479.54 g/mol
Exact Mass479.22
IUPAC NameN-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1OC1CCC(NC(=O)c2cnn3cc(OC4CCOCC4)ccc23)CC1
InChIInChI=1S/C25H29N5O5/c26-23(31)20-2-1-11-27-25(20)35-17-5-3-16(4-6-17)29-24(32)21-14-28-30-15-19(7-8-22(21)30)34-18-9-12-33-13-10-18/h1-2,7-8,11,14-18H,3-6,9-10,12-13H2,(H2,26,31)(H,29,32)
InChIKeyFFLNTSKZLHXIAF-UHFFFAOYSA-N
XLogP2.51
TPSA130.07 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms35
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.54
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide (CID 130248299) is N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide is NC(=O)c1cccnc1OC1CCC(NC(=O)c2cnn3cc(OC4CCOCC4)ccc23)CC1.
What is the InChIKey of N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is FFLNTSKZLHXIAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N5O5/c26-23(31)20-2-1-11-27-25(20)35-17-5-3-16(4-6-17)29-24(32)21-14-28-30-15-19(7-8-22(21)30)34-18-9-12-33-13-10-18/h1-2,7-8,11,14-18H,3-6,9-10,12-13H2,(H2,26,31)(H,29,32).
What are the key properties of N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide?
N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 479.54 g/mol, XLogP of 2.51, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-carbamoyl-2-pyridinyl)oxy]cyclohexyl]-6-(oxan-4-yloxy)pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 130248299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).