(1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine

C7H14N2 — CID 171036424

IUPAC(1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine
SMILESCN(C)[C@@]12CNCC1C2
InChIInChI=1S/C7H14N2/c1-9(2)7-3-6(7)4-8-5-7/h6,8H,3-5H2,1-2H3/t6?,7-/m0/s1
InChIKeyAZUHFCOQWFMZEW-MLWJPKLSSA-N
MW126.20 g/mol
LogP-0.09
Rot. Bonds1

About (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine

(1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine (PubChem CID 171036424) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine.

Molecular Properties

Compound Name(1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine
PubChem CID171036424
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name(1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine
SMILESCN(C)[C@@]12CNCC1C2
InChIInChI=1S/C7H14N2/c1-9(2)7-3-6(7)4-8-5-7/h6,8H,3-5H2,1-2H3/t6?,7-/m0/s1
InChIKeyAZUHFCOQWFMZEW-MLWJPKLSSA-N
XLogP-0.09
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethylbicyclo[1.1.0]butan-1-amine
CID 166476081
N,N-dimethylbicyclo[2.1.0]pentan-1-amine
CID 146785729
1-[(1S)-3-azabicyclo[3.1.0]hexan-1-yl]-N,N-dimethylmethanamine;dihydrochloride
CID 127256087
N-(3-azabicyclo[3.1.0]hexan-1-yl)-N-benzylcarbamate;hydrochloride
CID 129317751
2,3,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-3a-ol;dihydrochloride
CID 170913208
1-bromo-3-azabicyclo[3.1.0]hexane
CID 151929909
3a-fluoro-2,3,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;ethane;hydrofluoride
CID 177136763
molecular hydrogen;1-propan-2-yl-3-azabicyclo[3.1.0]hexane
CID 144912446
1-prop-1-ynyl-3-azabicyclo[3.1.0]hexane
CID 177211734
ethane;1-phenyl-3-azabicyclo[3.1.0]hexane
CID 90902808
(5S)-1-(4-methylphenyl)-3-azabicyclo[3.1.0]hexane
CID 90840976
ethane;(1R,5S)-1-phenyl-3-azabicyclo[3.1.0]hexane
CID 90850243

Frequently Asked Questions

What is the IUPAC name of (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine?
The IUPAC name of (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine (CID 171036424) is (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine.
What is the SMILES notation for (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine?
The canonical SMILES for (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine is CN(C)[C@@]12CNCC1C2.
What is the InChIKey of (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine?
The InChIKey is AZUHFCOQWFMZEW-MLWJPKLSSA-N. The full InChI is InChI=1S/C7H14N2/c1-9(2)7-3-6(7)4-8-5-7/h6,8H,3-5H2,1-2H3/t6?,7-/m0/s1.
What are the key properties of (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine?
(1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine has a molecular weight of 126.20 g/mol, XLogP of -0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine is sourced from PubChem (CID 171036424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).