2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide

C11H13N5O2 — CID 114195238

IUPAC2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide
SMILESN#CC1CN(c2cnc(N)cc2C(N)=O)CCO1
InChIInChI=1S/C11H13N5O2/c12-4-7-6-16(1-2-18-7)9-5-15-10(13)3-8(9)11(14)17/h3,5,7H,1-2,6H2,(H2,13,15)(H2,14,17)
InChIKeyFEBVFTXWIAOBLS-UHFFFAOYSA-N
MW247.26 g/mol
LogP-0.51
Rot. Bonds2

About 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide

2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide (PubChem CID 114195238) has the molecular formula C11H13N5O2 and a molecular weight of 247.26 g/mol. Its IUPAC name is 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide
PubChem CID114195238
Molecular FormulaC11H13N5O2
Molecular Weight247.26 g/mol
Exact Mass247.11
IUPAC Name2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide
SMILESN#CC1CN(c2cnc(N)cc2C(N)=O)CCO1
InChIInChI=1S/C11H13N5O2/c12-4-7-6-16(1-2-18-7)9-5-15-10(13)3-8(9)11(14)17/h3,5,7H,1-2,6H2,(H2,13,15)(H2,14,17)
InChIKeyFEBVFTXWIAOBLS-UHFFFAOYSA-N
XLogP-0.51
TPSA118.26 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide (CID 114195238) is 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide is N#CC1CN(c2cnc(N)cc2C(N)=O)CCO1.
What is the InChIKey of 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide?
The InChIKey is FEBVFTXWIAOBLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O2/c12-4-7-6-16(1-2-18-7)9-5-15-10(13)3-8(9)11(14)17/h3,5,7H,1-2,6H2,(H2,13,15)(H2,14,17).
What are the key properties of 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide?
2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide has a molecular weight of 247.26 g/mol, XLogP of -0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2-cyanomorpholin-4-yl)pyridine-4-carboxamide is sourced from PubChem (CID 114195238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).