N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide

C17H16N4O2 — CID 6539570

IUPACN-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide
SMILESCOc1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3n2)c1
InChIInChI=1S/C17H16N4O2/c1-23-12-4-2-3-11(9-12)14-8-7-13-15(18-14)20-21-16(13)19-17(22)10-5-6-10/h2-4,7-10H,5-6H2,1H3,(H2,18,19,20,21,22)
InChIKeyZFMMEJFOLCBUGE-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.98
Rot. Bonds4

About N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide

N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide (PubChem CID 6539570) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide
PubChem CID6539570
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC NameN-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide
SMILESCOc1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3n2)c1
InChIInChI=1S/C17H16N4O2/c1-23-12-4-2-3-11(9-12)14-8-7-13-15(18-14)20-21-16(13)19-17(22)10-5-6-10/h2-4,7-10H,5-6H2,1H3,(H2,18,19,20,21,22)
InChIKeyZFMMEJFOLCBUGE-UHFFFAOYSA-N
XLogP2.98
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide (CID 6539570) is N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide is COc1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3n2)c1.
What is the InChIKey of N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide?
The InChIKey is ZFMMEJFOLCBUGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-23-12-4-2-3-11(9-12)14-8-7-13-15(18-14)20-21-16(13)19-17(22)10-5-6-10/h2-4,7-10H,5-6H2,1H3,(H2,18,19,20,21,22).
What are the key properties of N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide?
N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide has a molecular weight of 308.34 g/mol, XLogP of 2.98, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-methoxyphenyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 6539570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).