2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide

C17H17N5O2 — CID 8892634

IUPAC2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1ccnn1Cc1ccccn1
InChIInChI=1S/C17H17N5O2/c1-2-24-17-14(7-5-10-19-17)16(23)21-15-8-11-20-22(15)12-13-6-3-4-9-18-13/h3-11H,2,12H2,1H3,(H,21,23)
InChIKeyMAYSDNCNHFHNSC-UHFFFAOYSA-N
MW323.36 g/mol
LogP2.37
Rot. Bonds6

About 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide

2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide (PubChem CID 8892634) has the molecular formula C17H17N5O2 and a molecular weight of 323.36 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide
PubChem CID8892634
Molecular FormulaC17H17N5O2
Molecular Weight323.36 g/mol
Exact Mass323.14
IUPAC Name2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)Nc1ccnn1Cc1ccccn1
InChIInChI=1S/C17H17N5O2/c1-2-24-17-14(7-5-10-19-17)16(23)21-15-8-11-20-22(15)12-13-6-3-4-9-18-13/h3-11H,2,12H2,1H3,(H,21,23)
InChIKeyMAYSDNCNHFHNSC-UHFFFAOYSA-N
XLogP2.37
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide (CID 8892634) is 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide is CCOc1ncccc1C(=O)Nc1ccnn1Cc1ccccn1.
What is the InChIKey of 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide?
The InChIKey is MAYSDNCNHFHNSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O2/c1-2-24-17-14(7-5-10-19-17)16(23)21-15-8-11-20-22(15)12-13-6-3-4-9-18-13/h3-11H,2,12H2,1H3,(H,21,23).
What are the key properties of 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide?
2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide has a molecular weight of 323.36 g/mol, XLogP of 2.37, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(pyridin-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide is sourced from PubChem (CID 8892634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).