4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide

C18H20N4O2 — CID 170502990

IUPAC4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide
SMILESCOc1ccc(-c2cc(C)c3c(cnn3CCCC(N)=O)n2)cc1
InChIInChI=1S/C18H20N4O2/c1-12-10-15(13-5-7-14(24-2)8-6-13)21-16-11-20-22(18(12)16)9-3-4-17(19)23/h5-8,10-11H,3-4,9H2,1-2H3,(H2,19,23)
InChIKeyICBKLFRGCQBLOI-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.68
Rot. Bonds6

About 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide

4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide (PubChem CID 170502990) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide.

Molecular Properties

Compound Name4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide
PubChem CID170502990
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC Name4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide
SMILESCOc1ccc(-c2cc(C)c3c(cnn3CCCC(N)=O)n2)cc1
InChIInChI=1S/C18H20N4O2/c1-12-10-15(13-5-7-14(24-2)8-6-13)21-16-11-20-22(18(12)16)9-3-4-17(19)23/h5-8,10-11H,3-4,9H2,1-2H3,(H2,19,23)
InChIKeyICBKLFRGCQBLOI-UHFFFAOYSA-N
XLogP2.68
TPSA83.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[5-(2,6-difluorophenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide
CID 169412894
4-[5-(8-methoxyquinolin-2-yl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide
CID 170503416
4-[7-methyl-5-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrazolo[4,5-b]pyridin-1-yl]butanamide
CID 169419894
4-[7-methyl-5-(3-methyl-1-prop-2-enylpyrazol-4-yl)pyrazolo[4,5-b]pyridin-1-yl]butanamide
CID 171913184
ethyl 4-(5-methoxybenzotriazol-1-yl)butanoate
CID 155778318
2-[5-(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2-yl]-N-(2,4,6-trimethylphenyl)acetamide
CID 51345679
N-(3,4-dimethylphenyl)-2-[5-(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2-yl]acetamide
CID 51345676
methyl N-[2-[4-(2-amino-2-oxoethoxy)phenyl]-4-methylquinolin-7-yl]carbamate
CID 169421328
2-[6-(4-methoxyphenyl)pyridazin-3-yl]sulfanylacetamide
CID 3227985
2-[4-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]butanoylamino]benzamide
CID 16885167
2-[5,6-bis(4-methoxyphenyl)pyrazolo[4,5-b]pyrazin-1-yl]ethyl acetate
CID 139633679
ethyl 6-(4-methoxyphenyl)pyridazine-4-carboxylate
CID 121205212

Frequently Asked Questions

What is the IUPAC name of 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide?
The IUPAC name of 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide (CID 170502990) is 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide.
What is the SMILES notation for 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide?
The canonical SMILES for 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide is COc1ccc(-c2cc(C)c3c(cnn3CCCC(N)=O)n2)cc1.
What is the InChIKey of 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide?
The InChIKey is ICBKLFRGCQBLOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-12-10-15(13-5-7-14(24-2)8-6-13)21-16-11-20-22(18(12)16)9-3-4-17(19)23/h5-8,10-11H,3-4,9H2,1-2H3,(H2,19,23).
What are the key properties of 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide?
4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide has a molecular weight of 324.38 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4-methoxyphenyl)-7-methylpyrazolo[4,5-b]pyridin-1-yl]butanamide is sourced from PubChem (CID 170502990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).