4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one

C11H15N3O2 — CID 118348357

IUPAC4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one
SMILESCC1(C)OCCN(c2ccc(N)nc2)C1=O
InChIInChI=1S/C11H15N3O2/c1-11(2)10(15)14(5-6-16-11)8-3-4-9(12)13-7-8/h3-4,7H,5-6H2,1-2H3,(H2,12,13)
InChIKeyDHJJXOOZBQHBEJ-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.81
Rot. Bonds1

About 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one

4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one (PubChem CID 118348357) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one.

Molecular Properties

Compound Name4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one
PubChem CID118348357
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one
SMILESCC1(C)OCCN(c2ccc(N)nc2)C1=O
InChIInChI=1S/C11H15N3O2/c1-11(2)10(15)14(5-6-16-11)8-3-4-9(12)13-7-8/h3-4,7H,5-6H2,1-2H3,(H2,12,13)
InChIKeyDHJJXOOZBQHBEJ-UHFFFAOYSA-N
XLogP0.81
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6-amino-3-pyridinyl)-3-methylpiperidin-2-one
CID 159461236
ethane;5-(1-oxa-8-azaspiro[3.5]nonan-8-yl)pyridin-2-amine
CID 145146822
5-[(2,2-dimethylmorpholin-4-yl)methyl]pyridin-2-amine
CID 62184542
tert-butyl 7-(6-amino-3-pyridinyl)-6-oxo-1,7-diazaspiro[4.4]nonane-1-carboxylate
CID 67354954
5-(2-oxa-8-azaspiro[4.5]decan-8-yl)pyridin-2-amine
CID 122520394
4-[6-[[2-(2,6-difluorophenyl)-5-hydroxy-6H-pyrrolo[3,4-b]pyridin-4-yl]amino]-3-pyridinyl]-2,2-dimethylmorpholin-3-one
CID 137060956
1-(6-amino-3-pyridinyl)piperidine-2,6-dione
CID 62899767
[4-(6-amino-3-pyridinyl)piperazin-1-yl]-(2,2-dimethylcyclopropyl)methanone
CID 107000234
5-(5-morpholin-4-yl-2-pyridinyl)pyridin-2-amine
CID 172791169
2-(6-amino-3-pyridinyl)-3,4,6,7-tetrahydropyrrolo[1,2-a]pyrazin-1-one
CID 67355578
5-(2,5-dihydropyrrol-1-yl)pyridin-2-amine
CID 65417066
5-(4-prop-1-en-2-ylpiperazin-1-yl)pyridin-2-amine
CID 176665681

Frequently Asked Questions

What is the IUPAC name of 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one?
The IUPAC name of 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one (CID 118348357) is 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one.
What is the SMILES notation for 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one?
The canonical SMILES for 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one is CC1(C)OCCN(c2ccc(N)nc2)C1=O.
What is the InChIKey of 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one?
The InChIKey is DHJJXOOZBQHBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-11(2)10(15)14(5-6-16-11)8-3-4-9(12)13-7-8/h3-4,7H,5-6H2,1-2H3,(H2,12,13).
What are the key properties of 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one?
4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one has a molecular weight of 221.26 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-amino-3-pyridinyl)-2,2-dimethylmorpholin-3-one is sourced from PubChem (CID 118348357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).