5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C14H17F2N5O — CID 138011128

IUPAC5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESNc1ccn2ncc(C(=O)NCC3CNCCC3(F)F)c2c1
InChIInChI=1S/C14H17F2N5O/c15-14(16)2-3-18-6-9(14)7-19-13(22)11-8-20-21-4-1-10(17)5-12(11)21/h1,4-5,8-9,18H,2-3,6-7,17H2,(H,19,22)
InChIKeyMHOHLBQSOBVLIC-UHFFFAOYSA-N
MW309.32 g/mol
LogP0.89
Rot. Bonds3

About 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 138011128) has the molecular formula C14H17F2N5O and a molecular weight of 309.32 g/mol. Its IUPAC name is 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID138011128
Molecular FormulaC14H17F2N5O
Molecular Weight309.32 g/mol
Exact Mass309.14
IUPAC Name5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESNc1ccn2ncc(C(=O)NCC3CNCCC3(F)F)c2c1
InChIInChI=1S/C14H17F2N5O/c15-14(16)2-3-18-6-9(14)7-19-13(22)11-8-20-21-4-1-10(17)5-12(11)21/h1,4-5,8-9,18H,2-3,6-7,17H2,(H,19,22)
InChIKeyMHOHLBQSOBVLIC-UHFFFAOYSA-N
XLogP0.89
TPSA84.45 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.32
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 138011128) is 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is Nc1ccn2ncc(C(=O)NCC3CNCCC3(F)F)c2c1.
What is the InChIKey of 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is MHOHLBQSOBVLIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F2N5O/c15-14(16)2-3-18-6-9(14)7-19-13(22)11-8-20-21-4-1-10(17)5-12(11)21/h1,4-5,8-9,18H,2-3,6-7,17H2,(H,19,22).
What are the key properties of 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 309.32 g/mol, XLogP of 0.89, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[(4,4-difluoropiperidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 138011128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).