N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C23H24N4O4 — CID 55577108

IUPACN-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1cc(CNC(=O)c2cc(-c3ccco3)nc3c2cnn3C(C)C)cc(OC)c1
InChIInChI=1S/C23H24N4O4/c1-14(2)27-22-19(13-25-27)18(11-20(26-22)21-6-5-7-31-21)23(28)24-12-15-8-16(29-3)10-17(9-15)30-4/h5-11,13-14H,12H2,1-4H3,(H,24,28)
InChIKeyFGXXOMGDXQQFKY-UHFFFAOYSA-N
MW420.47 g/mol
LogP4.22
Rot. Bonds7

About N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 55577108) has the molecular formula C23H24N4O4 and a molecular weight of 420.47 g/mol. Its IUPAC name is N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID55577108
Molecular FormulaC23H24N4O4
Molecular Weight420.47 g/mol
Exact Mass420.18
IUPAC NameN-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1cc(CNC(=O)c2cc(-c3ccco3)nc3c2cnn3C(C)C)cc(OC)c1
InChIInChI=1S/C23H24N4O4/c1-14(2)27-22-19(13-25-27)18(11-20(26-22)21-6-5-7-31-21)23(28)24-12-15-8-16(29-3)10-17(9-15)30-4/h5-11,13-14H,12H2,1-4H3,(H,24,28)
InChIKeyFGXXOMGDXQQFKY-UHFFFAOYSA-N
XLogP4.22
TPSA91.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.47
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-(furan-2-yl)-1-propan-2-yl-N-[(3,4,5-trimethoxyphenyl)methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 36936644
6-(furan-2-yl)-N-[[4-(methoxymethyl)phenyl]methyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 39270156
6-(furan-2-yl)-1-propan-2-yl-N-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 51291950
6-(furan-2-yl)-N-[(2-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 38535692
propan-2-yl 3-[[6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carbonyl]amino]propanoate
CID 51292319
N-[2-(ethylamino)-2-oxoethyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 86914644
N-(2-benzamidoethyl)-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 38206296
N-ethoxy-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 46536338
6-(furan-2-yl)-1-propan-2-yl-N-[[3-(pyrrolidine-1-carbonyl)phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 55722233
N-(3-amino-2-methylpropyl)-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide;dihydrochloride
CID 119996921
methyl 2-[[6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carbonyl]amino]-2-methylpropanoate
CID 30875618
methyl 2-[[4-[[6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carbonyl]amino]benzoyl]amino]acetate
CID 33088168

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 55577108) is N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is COc1cc(CNC(=O)c2cc(-c3ccco3)nc3c2cnn3C(C)C)cc(OC)c1.
What is the InChIKey of N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is FGXXOMGDXQQFKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O4/c1-14(2)27-22-19(13-25-27)18(11-20(26-22)21-6-5-7-31-21)23(28)24-12-15-8-16(29-3)10-17(9-15)30-4/h5-11,13-14H,12H2,1-4H3,(H,24,28).
What are the key properties of N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 420.47 g/mol, XLogP of 4.22, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethoxyphenyl)methyl]-6-(furan-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 55577108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).