2-morpholin-4-ylpyridine-3,5-diamine

C9H14N4O — CID 21082858

IUPAC2-morpholin-4-ylpyridine-3,5-diamine
SMILESNc1cnc(N2CCOCC2)c(N)c1
InChIInChI=1S/C9H14N4O/c10-7-5-8(11)9(12-6-7)13-1-3-14-4-2-13/h5-6H,1-4,10-11H2
InChIKeyZDAJRYQFACBWFI-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.08
Rot. Bonds1

About 2-morpholin-4-ylpyridine-3,5-diamine

2-morpholin-4-ylpyridine-3,5-diamine (PubChem CID 21082858) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is 2-morpholin-4-ylpyridine-3,5-diamine.

Molecular Properties

Compound Name2-morpholin-4-ylpyridine-3,5-diamine
PubChem CID21082858
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name2-morpholin-4-ylpyridine-3,5-diamine
SMILESNc1cnc(N2CCOCC2)c(N)c1
InChIInChI=1S/C9H14N4O/c10-7-5-8(11)9(12-6-7)13-1-3-14-4-2-13/h5-6H,1-4,10-11H2
InChIKeyZDAJRYQFACBWFI-UHFFFAOYSA-N
XLogP0.08
TPSA77.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylpyridine-3,5-diamine?
The IUPAC name of 2-morpholin-4-ylpyridine-3,5-diamine (CID 21082858) is 2-morpholin-4-ylpyridine-3,5-diamine.
What is the SMILES notation for 2-morpholin-4-ylpyridine-3,5-diamine?
The canonical SMILES for 2-morpholin-4-ylpyridine-3,5-diamine is Nc1cnc(N2CCOCC2)c(N)c1.
What is the InChIKey of 2-morpholin-4-ylpyridine-3,5-diamine?
The InChIKey is ZDAJRYQFACBWFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c10-7-5-8(11)9(12-6-7)13-1-3-14-4-2-13/h5-6H,1-4,10-11H2.
What are the key properties of 2-morpholin-4-ylpyridine-3,5-diamine?
2-morpholin-4-ylpyridine-3,5-diamine has a molecular weight of 194.24 g/mol, XLogP of 0.08, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylpyridine-3,5-diamine is sourced from PubChem (CID 21082858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).