2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one

C16H17N3O2 — CID 175843982

IUPAC2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one
SMILESCCn1cc2c(ccc(=O)n2Cc2ccc(OC)cc2)n1
InChIInChI=1S/C16H17N3O2/c1-3-18-11-15-14(17-18)8-9-16(20)19(15)10-12-4-6-13(21-2)7-5-12/h4-9,11H,3,10H2,1-2H3
InChIKeyNJEBPOCCWZFTPX-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.27
Rot. Bonds4

About 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one

2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one (PubChem CID 175843982) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one.

Molecular Properties

Compound Name2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one
PubChem CID175843982
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one
SMILESCCn1cc2c(ccc(=O)n2Cc2ccc(OC)cc2)n1
InChIInChI=1S/C16H17N3O2/c1-3-18-11-15-14(17-18)8-9-16(20)19(15)10-12-4-6-13(21-2)7-5-12/h4-9,11H,3,10H2,1-2H3
InChIKeyNJEBPOCCWZFTPX-UHFFFAOYSA-N
XLogP2.27
TPSA49.05 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-chloro-2-ethyl-4-[(4-methoxyphenyl)methyl]-5-oxopyrazolo[4,3-b]pyridine-6-carbaldehyde
CID 138633826
7-bromo-1-[(4-methoxyphenyl)methyl]-1,5-naphthyridin-2-one
CID 67993011
7-chloro-2-ethyl-6-(6-methoxy-1H-benzimidazol-2-yl)-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one
CID 138633811
2-ethyl-5-methoxyindazole
CID 10856015
1-[(4-methoxyphenyl)methyl]quinoxalin-2-one
CID 15497841
5-amino-1-[(4-methoxyphenyl)methyl]quinolin-2-one
CID 118001654
5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one
CID 118001666
2-[(4-methoxyphenyl)methyl]-5H-pyrazolo[4,3-c]pyridin-4-one
CID 154637502
N-(3,5-dimethoxyphenyl)-2-[2-ethyl-6-[(4-methoxyphenyl)methyl]-7-oxopyrazolo[4,3-d]pyrimidin-5-yl]sulfanylacetamide
CID 22424342
2-[2-ethyl-6-[(4-methoxyphenyl)methyl]-7-oxopyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl-N-phenylacetamide
CID 20937459
5-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]pyridin-2-one
CID 69444298
7-chloro-2-ethyl-6-[5-(2-hydroxyethylamino)-6-methyl-1H-benzimidazol-2-yl]-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one
CID 167112505

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one?
The IUPAC name of 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one (CID 175843982) is 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one.
What is the SMILES notation for 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one?
The canonical SMILES for 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one is CCn1cc2c(ccc(=O)n2Cc2ccc(OC)cc2)n1.
What is the InChIKey of 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one?
The InChIKey is NJEBPOCCWZFTPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-3-18-11-15-14(17-18)8-9-16(20)19(15)10-12-4-6-13(21-2)7-5-12/h4-9,11H,3,10H2,1-2H3.
What are the key properties of 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one?
2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one has a molecular weight of 283.33 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one is sourced from PubChem (CID 175843982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).