5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide

C20H19F2N5O3 — CID 155167237

IUPAC5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide
SMILESNC(=O)c1cn2nc(C3CCOCC3)cc2cc1NC(=O)c1cccc(C(F)F)n1
InChIInChI=1S/C20H19F2N5O3/c21-18(22)14-2-1-3-15(24-14)20(29)25-17-9-12-8-16(11-4-6-30-7-5-11)26-27(12)10-13(17)19(23)28/h1-3,8-11,18H,4-7H2,(H2,23,28)(H,25,29)
InChIKeyKFIGAJNZXJLSQP-UHFFFAOYSA-N
MW415.40 g/mol
LogP2.91
Rot. Bonds5

About 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide

5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide (PubChem CID 155167237) has the molecular formula C20H19F2N5O3 and a molecular weight of 415.40 g/mol. Its IUPAC name is 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide
PubChem CID155167237
Molecular FormulaC20H19F2N5O3
Molecular Weight415.40 g/mol
Exact Mass415.15
IUPAC Name5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide
SMILESNC(=O)c1cn2nc(C3CCOCC3)cc2cc1NC(=O)c1cccc(C(F)F)n1
InChIInChI=1S/C20H19F2N5O3/c21-18(22)14-2-1-3-15(24-14)20(29)25-17-9-12-8-16(11-4-6-30-7-5-11)26-27(12)10-13(17)19(23)28/h1-3,8-11,18H,4-7H2,(H2,23,28)(H,25,29)
InChIKeyKFIGAJNZXJLSQP-UHFFFAOYSA-N
XLogP2.91
TPSA111.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.40
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide?
The IUPAC name of 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide (CID 155167237) is 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide.
What is the SMILES notation for 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide?
The canonical SMILES for 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide is NC(=O)c1cn2nc(C3CCOCC3)cc2cc1NC(=O)c1cccc(C(F)F)n1.
What is the InChIKey of 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide?
The InChIKey is KFIGAJNZXJLSQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19F2N5O3/c21-18(22)14-2-1-3-15(24-14)20(29)25-17-9-12-8-16(11-4-6-30-7-5-11)26-27(12)10-13(17)19(23)28/h1-3,8-11,18H,4-7H2,(H2,23,28)(H,25,29).
What are the key properties of 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide?
5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide has a molecular weight of 415.40 g/mol, XLogP of 2.91, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)pyrazolo[1,5-a]pyridine-6-carboxamide is sourced from PubChem (CID 155167237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).