N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C19H14N6O3 — CID 146096805

IUPACN-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESN#CCONC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1
InChIInChI=1S/C19H14N6O3/c20-5-8-28-24-19(26)15-9-17(13-3-1-6-21-10-13)23-18-16(15)11-22-25(18)12-14-4-2-7-27-14/h1-4,6-7,9-11H,8,12H2,(H,24,26)
InChIKeyUAZSJXUBPNYWHF-UHFFFAOYSA-N
MW374.36 g/mol
LogP2.32
Rot. Bonds6

About N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide

N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 146096805) has the molecular formula C19H14N6O3 and a molecular weight of 374.36 g/mol. Its IUPAC name is N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID146096805
Molecular FormulaC19H14N6O3
Molecular Weight374.36 g/mol
Exact Mass374.11
IUPAC NameN-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESN#CCONC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1
InChIInChI=1S/C19H14N6O3/c20-5-8-28-24-19(26)15-9-17(13-3-1-6-21-10-13)23-18-16(15)11-22-25(18)12-14-4-2-7-27-14/h1-4,6-7,9-11H,8,12H2,(H,24,26)
InChIKeyUAZSJXUBPNYWHF-UHFFFAOYSA-N
XLogP2.32
TPSA118.86 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.36
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(furan-2-ylmethyl)-N-(4-methyl-2-pyridinyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55522023
1-(furan-2-ylmethyl)-6-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 55504742
N-(furan-2-ylmethyl)-6-pyridin-3-yl-1-(pyridin-3-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 78835342
[1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridin-4-yl]-pyrrolidin-1-ylmethanone
CID 55503967
1-(furan-2-ylmethyl)-N-[2-(2-methylphenyl)ethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55504581
N-[1-(2-chlorophenyl)ethyl]-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55504407
N-[(2,5-dimethoxyphenyl)methyl]-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55545738
1-(furan-2-ylmethyl)-N-[3-(4-methylpiperidin-1-yl)propyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 52554963
1-(furan-2-ylmethyl)-N-[[3-(methylcarbamoyl)phenyl]methyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55609349
1-(furan-2-ylmethyl)-N-[4-[2-oxo-2-(propan-2-ylamino)ethyl]phenyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55610578
1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55505283
N-(2-methylbutoxy)-6-pyridin-3-yl-1-(pyridin-3-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 146075855

Frequently Asked Questions

What is the IUPAC name of N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 146096805) is N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide is N#CCONC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1.
What is the InChIKey of N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is UAZSJXUBPNYWHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N6O3/c20-5-8-28-24-19(26)15-9-17(13-3-1-6-21-10-13)23-18-16(15)11-22-25(18)12-14-4-2-7-27-14/h1-4,6-7,9-11H,8,12H2,(H,24,26).
What are the key properties of N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 374.36 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyanomethoxy)-1-(furan-2-ylmethyl)-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 146096805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).