3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide

C17H14N4O2 — CID 51038159

IUPAC3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide
SMILESCc1cccc(C(=O)Nc2cccc(Oc3cncnc3)n2)c1
InChIInChI=1S/C17H14N4O2/c1-12-4-2-5-13(8-12)17(22)21-15-6-3-7-16(20-15)23-14-9-18-11-19-10-14/h2-11H,1H3,(H,20,21,22)
InChIKeyZRFRSIPNAPDWAY-UHFFFAOYSA-N
MW306.33 g/mol
LogP3.22
Rot. Bonds4

About 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide

3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide (PubChem CID 51038159) has the molecular formula C17H14N4O2 and a molecular weight of 306.33 g/mol. Its IUPAC name is 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide
PubChem CID51038159
Molecular FormulaC17H14N4O2
Molecular Weight306.33 g/mol
Exact Mass306.11
IUPAC Name3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide
SMILESCc1cccc(C(=O)Nc2cccc(Oc3cncnc3)n2)c1
InChIInChI=1S/C17H14N4O2/c1-12-4-2-5-13(8-12)17(22)21-15-6-3-7-16(20-15)23-14-9-18-11-19-10-14/h2-11H,1H3,(H,20,21,22)
InChIKeyZRFRSIPNAPDWAY-UHFFFAOYSA-N
XLogP3.22
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide?
The IUPAC name of 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide (CID 51038159) is 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide.
What is the SMILES notation for 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide?
The canonical SMILES for 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide is Cc1cccc(C(=O)Nc2cccc(Oc3cncnc3)n2)c1.
What is the InChIKey of 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide?
The InChIKey is ZRFRSIPNAPDWAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2/c1-12-4-2-5-13(8-12)17(22)21-15-6-3-7-16(20-15)23-14-9-18-11-19-10-14/h2-11H,1H3,(H,20,21,22).
What are the key properties of 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide?
3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide has a molecular weight of 306.33 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(6-pyrimidin-5-yloxy-2-pyridinyl)benzamide is sourced from PubChem (CID 51038159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).