1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide

C18H20N4O2 — CID 39886143

IUPAC1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCCn1nc(C)c2cc(C(=O)Nc3cccc(OC)c3)c(C)nc21
InChIInChI=1S/C18H20N4O2/c1-5-22-17-15(12(3)21-22)10-16(11(2)19-17)18(23)20-13-7-6-8-14(9-13)24-4/h6-10H,5H2,1-4H3,(H,20,23)
InChIKeyRWKAYADJZGXKTP-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.33
Rot. Bonds4

About 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide

1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 39886143) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
PubChem CID39886143
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC Name1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCCn1nc(C)c2cc(C(=O)Nc3cccc(OC)c3)c(C)nc21
InChIInChI=1S/C18H20N4O2/c1-5-22-17-15(12(3)21-22)10-16(11(2)19-17)18(23)20-13-7-6-8-14(9-13)24-4/h6-10H,5H2,1-4H3,(H,20,23)
InChIKeyRWKAYADJZGXKTP-UHFFFAOYSA-N
XLogP3.33
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-N-(3-methoxyphenyl)-3-methylpyrazole-4-carboxamide
CID 19474230
2-(4-ethylpiperazin-1-yl)-N-(3-methoxyphenyl)-4-methylpyrimidine-5-carboxamide
CID 66504041
N-(3-methoxyphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 31853978
N-(3-methoxyphenyl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 17498937
1-ethyl-3-(2-fluoro-4-methoxyphenyl)-N-(3-methoxyphenyl)pyrazole-5-carboxamide
CID 46105523
2,3-dimethoxy-N-(3-methoxyphenyl)benzamide
CID 912443
6-methoxy-2-methyl-N-[3-(trifluoromethoxy)phenyl]quinoline-3-carboxamide
CID 38033463
N-(3-methoxyphenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 19481236
2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
methyl 1-ethyl-6-(3-methoxyphenyl)-3-methylpyrazolo[5,4-b]pyridine-4-carboxylate
CID 19585703
N-(3-methoxyphenyl)-1,5-dimethylpyrazole-3-carboxamide
CID 19279593
N-[2-[(3-methoxyphenyl)carbamoyl]phenyl]-2-methylbenzamide
CID 51154926

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide?
The IUPAC name of 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide (CID 39886143) is 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide.
What is the SMILES notation for 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide?
The canonical SMILES for 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide is CCn1nc(C)c2cc(C(=O)Nc3cccc(OC)c3)c(C)nc21.
What is the InChIKey of 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide?
The InChIKey is RWKAYADJZGXKTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-5-22-17-15(12(3)21-22)10-16(11(2)19-17)18(23)20-13-7-6-8-14(9-13)24-4/h6-10H,5H2,1-4H3,(H,20,23).
What are the key properties of 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide?
1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(3-methoxyphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 39886143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).