N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide

C16H16N4O2 — CID 22319606

IUPACN-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide
SMILESCCCC(=O)Nc1n[nH]c2cc(-c3ccc(=O)[nH]c3)ccc12
InChIInChI=1S/C16H16N4O2/c1-2-3-15(22)18-16-12-6-4-10(8-13(12)19-20-16)11-5-7-14(21)17-9-11/h4-9H,2-3H2,1H3,(H,17,21)(H2,18,19,20,22)
InChIKeyUUXLQKKBOYQWIZ-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.66
Rot. Bonds4

About N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide

N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide (PubChem CID 22319606) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide.

Molecular Properties

Compound NameN-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide
PubChem CID22319606
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC NameN-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide
SMILESCCCC(=O)Nc1n[nH]c2cc(-c3ccc(=O)[nH]c3)ccc12
InChIInChI=1S/C16H16N4O2/c1-2-3-15(22)18-16-12-6-4-10(8-13(12)19-20-16)11-5-7-14(21)17-9-11/h4-9H,2-3H2,1H3,(H,17,21)(H2,18,19,20,22)
InChIKeyUUXLQKKBOYQWIZ-UHFFFAOYSA-N
XLogP2.66
TPSA90.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide?
The IUPAC name of N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide (CID 22319606) is N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide.
What is the SMILES notation for N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide?
The canonical SMILES for N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide is CCCC(=O)Nc1n[nH]c2cc(-c3ccc(=O)[nH]c3)ccc12.
What is the InChIKey of N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide?
The InChIKey is UUXLQKKBOYQWIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c1-2-3-15(22)18-16-12-6-4-10(8-13(12)19-20-16)11-5-7-14(21)17-9-11/h4-9H,2-3H2,1H3,(H,17,21)(H2,18,19,20,22).
What are the key properties of N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide?
N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide has a molecular weight of 296.33 g/mol, XLogP of 2.66, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(6-oxo-1H-pyridin-3-yl)-1H-indazol-3-yl]butanamide is sourced from PubChem (CID 22319606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).