[2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone

C12H21N3O2 — CID 145047621

IUPAC[2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone
SMILESCNN1CC2(CC(C(=O)N3CCOCC3)C2)C1
InChIInChI=1S/C12H21N3O2/c1-13-15-8-12(9-15)6-10(7-12)11(16)14-2-4-17-5-3-14/h10,13H,2-9H2,1H3
InChIKeyRWWWSDZEDRUFNB-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.31
Rot. Bonds2

About [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone

[2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone (PubChem CID 145047621) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone
PubChem CID145047621
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name[2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone
SMILESCNN1CC2(CC(C(=O)N3CCOCC3)C2)C1
InChIInChI=1S/C12H21N3O2/c1-13-15-8-12(9-15)6-10(7-12)11(16)14-2-4-17-5-3-14/h10,13H,2-9H2,1H3
InChIKeyRWWWSDZEDRUFNB-UHFFFAOYSA-N
XLogP-0.31
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[4-(morpholine-4-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 109146746
[1-(3,3-dimethylcyclopentyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 154564551
cyclopropyl-[4-(morpholine-4-carbonyl)piperazin-1-yl]methanone
CID 110346881
cyclohexyl-[(3R)-2-methyl-3-(morpholin-4-ylmethyl)-2,8-diazaspiro[4.5]decan-8-yl]methanone
CID 164635363
[(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone
CID 24881834
(5-methyloxolan-3-yl)-morpholin-4-ylmethanone
CID 114826121
(1-tert-butylpiperidin-4-yl)-morpholin-4-ylmethanone
CID 21061611
[(3R)-1-methylpiperidin-3-yl]-morpholin-4-ylmethanone
CID 95907299
(4-tert-butylcyclohexyl)-morpholin-4-ylmethanone;ethane
CID 164918983
1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
CID 110604424
(1,1-dioxothian-4-yl)-morpholin-4-ylmethanone
CID 110849366
1-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-morpholin-4-ylethane-1,2-dione
CID 55467380

Frequently Asked Questions

What is the IUPAC name of [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone?
The IUPAC name of [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone (CID 145047621) is [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone is CNN1CC2(CC(C(=O)N3CCOCC3)C2)C1.
What is the InChIKey of [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone?
The InChIKey is RWWWSDZEDRUFNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-13-15-8-12(9-15)6-10(7-12)11(16)14-2-4-17-5-3-14/h10,13H,2-9H2,1H3.
What are the key properties of [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone?
[2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone has a molecular weight of 239.32 g/mol, XLogP of -0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methylamino)-2-azaspiro[3.3]heptan-6-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 145047621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).