2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide

C9H17N3O — CID 131207561

IUPAC2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide
SMILESCN(C)C1C2CN(CC(N)=O)CC21
InChIInChI=1S/C9H17N3O/c1-11(2)9-6-3-12(4-7(6)9)5-8(10)13/h6-7,9H,3-5H2,1-2H3,(H2,10,13)
InChIKeyWTTKQFLWVZLOIP-UHFFFAOYSA-N
MW183.25 g/mol
LogP-1.04
Rot. Bonds3

About 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide

2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide (PubChem CID 131207561) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide.

Molecular Properties

Compound Name2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide
PubChem CID131207561
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide
SMILESCN(C)C1C2CN(CC(N)=O)CC21
InChIInChI=1S/C9H17N3O/c1-11(2)9-6-3-12(4-7(6)9)5-8(10)13/h6-7,9H,3-5H2,1-2H3,(H2,10,13)
InChIKeyWTTKQFLWVZLOIP-UHFFFAOYSA-N
XLogP-1.04
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 5-1.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3R,4S)-3,4-dihydroxypyrrolidin-1-yl]acetamide
CID 79410228
2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide
CID 130757921
2-[(3aR,7aS)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]acetamide
CID 130961650
λ2-plumbane;2-[4,7,10-tris(2-amino-2-oxoethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetamide
CID 163474801
2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide
CID 160796876
2-(3-amino-5-propylpiperidin-1-yl)acetamide
CID 83989452
2-[3-(methylamino)pyrrolidin-1-yl]acetamide
CID 74958986
2-(azetidin-1-yl)acetamide
CID 18923030
2-[3,4-dihydroxy-5-(hydroxymethyl)piperidin-1-yl]acetamide
CID 18797121
2-[(3R)-3-fluoropyrrolidin-1-yl]acetamide;2-methylpropane
CID 162181974
2-(4-acetylpiperidin-1-yl)acetamide
CID 59463755
2-(4-ethylpiperidin-1-yl)acetamide
CID 23381133

Frequently Asked Questions

What is the IUPAC name of 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide?
The IUPAC name of 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide (CID 131207561) is 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide.
What is the SMILES notation for 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide?
The canonical SMILES for 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide is CN(C)C1C2CN(CC(N)=O)CC21.
What is the InChIKey of 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide?
The InChIKey is WTTKQFLWVZLOIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-11(2)9-6-3-12(4-7(6)9)5-8(10)13/h6-7,9H,3-5H2,1-2H3,(H2,10,13).
What are the key properties of 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide?
2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide has a molecular weight of 183.25 g/mol, XLogP of -1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]acetamide is sourced from PubChem (CID 131207561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).