2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile

C10H10N4O2 — CID 91756494

IUPAC2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile
SMILESN#Cc1cc(N2CCOCC2=O)cnc1N
InChIInChI=1S/C10H10N4O2/c11-4-7-3-8(5-13-10(7)12)14-1-2-16-6-9(14)15/h3,5H,1-2,6H2,(H2,12,13)
InChIKeyDMWHXYIJSWMGHE-UHFFFAOYSA-N
MW218.22 g/mol
LogP-0.10
Rot. Bonds1

About 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile

2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile (PubChem CID 91756494) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile
PubChem CID91756494
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC Name2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile
SMILESN#Cc1cc(N2CCOCC2=O)cnc1N
InChIInChI=1S/C10H10N4O2/c11-4-7-3-8(5-13-10(7)12)14-1-2-16-6-9(14)15/h3,5H,1-2,6H2,(H2,12,13)
InChIKeyDMWHXYIJSWMGHE-UHFFFAOYSA-N
XLogP-0.10
TPSA92.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile (CID 91756494) is 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile is N#Cc1cc(N2CCOCC2=O)cnc1N.
What is the InChIKey of 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile?
The InChIKey is DMWHXYIJSWMGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c11-4-7-3-8(5-13-10(7)12)14-1-2-16-6-9(14)15/h3,5H,1-2,6H2,(H2,12,13).
What are the key properties of 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile?
2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile has a molecular weight of 218.22 g/mol, XLogP of -0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 91756494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).