4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide

C16H13N5O3 — CID 58349110

IUPAC4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)Nc2cncc(Oc3cncnc3)c2)c1
InChIInChI=1S/C16H13N5O3/c1-23-12-2-3-20-15(5-12)16(22)21-11-4-13(7-17-6-11)24-14-8-18-10-19-9-14/h2-10H,1H3,(H,21,22)
InChIKeyAZUIZRZHYQEQLC-UHFFFAOYSA-N
MW323.31 g/mol
LogP2.32
Rot. Bonds5

About 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide

4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide (PubChem CID 58349110) has the molecular formula C16H13N5O3 and a molecular weight of 323.31 g/mol. Its IUPAC name is 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide
PubChem CID58349110
Molecular FormulaC16H13N5O3
Molecular Weight323.31 g/mol
Exact Mass323.10
IUPAC Name4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)Nc2cncc(Oc3cncnc3)c2)c1
InChIInChI=1S/C16H13N5O3/c1-23-12-2-3-20-15(5-12)16(22)21-11-4-13(7-17-6-11)24-14-8-18-10-19-9-14/h2-10H,1H3,(H,21,22)
InChIKeyAZUIZRZHYQEQLC-UHFFFAOYSA-N
XLogP2.32
TPSA99.12 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide?
The IUPAC name of 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide (CID 58349110) is 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide?
The canonical SMILES for 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide is COc1ccnc(C(=O)Nc2cncc(Oc3cncnc3)c2)c1.
What is the InChIKey of 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide?
The InChIKey is AZUIZRZHYQEQLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N5O3/c1-23-12-2-3-20-15(5-12)16(22)21-11-4-13(7-17-6-11)24-14-8-18-10-19-9-14/h2-10H,1H3,(H,21,22).
What are the key properties of 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide?
4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide has a molecular weight of 323.31 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide is sourced from PubChem (CID 58349110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).