N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide

C15H20N6O2 — CID 169114768

IUPACN-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide
SMILESC[C@@H]1CCC[C@H](C)N1C(=O)C(=O)Nc1cnc(N)c2cn[nH]c12
InChIInChI=1S/C15H20N6O2/c1-8-4-3-5-9(2)21(8)15(23)14(22)19-11-7-17-13(16)10-6-18-20-12(10)11/h6-9H,3-5H2,1-2H3,(H2,16,17)(H,18,20)(H,19,22)/t8-,9+
InChIKeyOGYOECSICYVINJ-DTORHVGOSA-N
MW316.37 g/mol
LogP1.27
Rot. Bonds1

About N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide

N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide (PubChem CID 169114768) has the molecular formula C15H20N6O2 and a molecular weight of 316.37 g/mol. Its IUPAC name is N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide.

Molecular Properties

Compound NameN-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide
PubChem CID169114768
Molecular FormulaC15H20N6O2
Molecular Weight316.37 g/mol
Exact Mass316.16
IUPAC NameN-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide
SMILESC[C@@H]1CCC[C@H](C)N1C(=O)C(=O)Nc1cnc(N)c2cn[nH]c12
InChIInChI=1S/C15H20N6O2/c1-8-4-3-5-9(2)21(8)15(23)14(22)19-11-7-17-13(16)10-6-18-20-12(10)11/h6-9H,3-5H2,1-2H3,(H2,16,17)(H,18,20)(H,19,22)/t8-,9+
InChIKeyOGYOECSICYVINJ-DTORHVGOSA-N
XLogP1.27
TPSA117.00 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.37
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide?
The IUPAC name of N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide (CID 169114768) is N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide.
What is the SMILES notation for N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide?
The canonical SMILES for N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide is C[C@@H]1CCC[C@H](C)N1C(=O)C(=O)Nc1cnc(N)c2cn[nH]c12.
What is the InChIKey of N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide?
The InChIKey is OGYOECSICYVINJ-DTORHVGOSA-N. The full InChI is InChI=1S/C15H20N6O2/c1-8-4-3-5-9(2)21(8)15(23)14(22)19-11-7-17-13(16)10-6-18-20-12(10)11/h6-9H,3-5H2,1-2H3,(H2,16,17)(H,18,20)(H,19,22)/t8-,9+.
What are the key properties of N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide?
N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide has a molecular weight of 316.37 g/mol, XLogP of 1.27, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1H-pyrazolo[4,5-c]pyridin-7-yl)-2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoacetamide is sourced from PubChem (CID 169114768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).