5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide

C14H19N3O2 — CID 122276318

IUPAC5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)NC2CCC23CCOCC3)cn1
InChIInChI=1S/C14H19N3O2/c1-10-8-16-11(9-15-10)13(18)17-12-2-3-14(12)4-6-19-7-5-14/h8-9,12H,2-7H2,1H3,(H,17,18)
InChIKeyUNMIXIDVNHCTKY-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.47
Rot. Bonds2

About 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide

5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide (PubChem CID 122276318) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide
PubChem CID122276318
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)NC2CCC23CCOCC3)cn1
InChIInChI=1S/C14H19N3O2/c1-10-8-16-11(9-15-10)13(18)17-12-2-3-14(12)4-6-19-7-5-14/h8-9,12H,2-7H2,1H3,(H,17,18)
InChIKeyUNMIXIDVNHCTKY-UHFFFAOYSA-N
XLogP1.47
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide (CID 122276318) is 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide is Cc1cnc(C(=O)NC2CCC23CCOCC3)cn1.
What is the InChIKey of 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide?
The InChIKey is UNMIXIDVNHCTKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-10-8-16-11(9-15-10)13(18)17-12-2-3-14(12)4-6-19-7-5-14/h8-9,12H,2-7H2,1H3,(H,17,18).
What are the key properties of 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide?
5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide has a molecular weight of 261.32 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 122276318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).