N-(6-pyridin-3-ylcinnolin-3-yl)acetamide

C15H12N4O — CID 154592116

IUPACN-(6-pyridin-3-ylcinnolin-3-yl)acetamide
SMILESCC(=O)Nc1cc2cc(-c3cccnc3)ccc2nn1
InChIInChI=1S/C15H12N4O/c1-10(20)17-15-8-13-7-11(4-5-14(13)18-19-15)12-3-2-6-16-9-12/h2-9H,1H3,(H,17,19,20)
InChIKeyQXGRYYSKJAXSDT-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.65
Rot. Bonds2

About N-(6-pyridin-3-ylcinnolin-3-yl)acetamide

N-(6-pyridin-3-ylcinnolin-3-yl)acetamide (PubChem CID 154592116) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is N-(6-pyridin-3-ylcinnolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(6-pyridin-3-ylcinnolin-3-yl)acetamide
PubChem CID154592116
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC NameN-(6-pyridin-3-ylcinnolin-3-yl)acetamide
SMILESCC(=O)Nc1cc2cc(-c3cccnc3)ccc2nn1
InChIInChI=1S/C15H12N4O/c1-10(20)17-15-8-13-7-11(4-5-14(13)18-19-15)12-3-2-6-16-9-12/h2-9H,1H3,(H,17,19,20)
InChIKeyQXGRYYSKJAXSDT-UHFFFAOYSA-N
XLogP2.65
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-pyridin-3-ylcinnolin-3-yl)acetamide?
The IUPAC name of N-(6-pyridin-3-ylcinnolin-3-yl)acetamide (CID 154592116) is N-(6-pyridin-3-ylcinnolin-3-yl)acetamide.
What is the SMILES notation for N-(6-pyridin-3-ylcinnolin-3-yl)acetamide?
The canonical SMILES for N-(6-pyridin-3-ylcinnolin-3-yl)acetamide is CC(=O)Nc1cc2cc(-c3cccnc3)ccc2nn1.
What is the InChIKey of N-(6-pyridin-3-ylcinnolin-3-yl)acetamide?
The InChIKey is QXGRYYSKJAXSDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c1-10(20)17-15-8-13-7-11(4-5-14(13)18-19-15)12-3-2-6-16-9-12/h2-9H,1H3,(H,17,19,20).
What are the key properties of N-(6-pyridin-3-ylcinnolin-3-yl)acetamide?
N-(6-pyridin-3-ylcinnolin-3-yl)acetamide has a molecular weight of 264.29 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-pyridin-3-ylcinnolin-3-yl)acetamide is sourced from PubChem (CID 154592116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).