(1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine

C6H12N2 — CID 67681325

IUPAC(1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine
SMILESC[C@@H]1C[C@H]2C[C@H]2N1N
InChIInChI=1S/C6H12N2/c1-4-2-5-3-6(5)8(4)7/h4-6H,2-3,7H2,1H3/t4-,5+,6-/m1/s1
InChIKeyKJSBEEMANSIKPH-NGJCXOISSA-N
MW112.18 g/mol
LogP0.34
Rot. Bonds

About (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine

(1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine (PubChem CID 67681325) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine.

Molecular Properties

Compound Name(1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine
PubChem CID67681325
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name(1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine
SMILESC[C@@H]1C[C@H]2C[C@H]2N1N
InChIInChI=1S/C6H12N2/c1-4-2-5-3-6(5)8(4)7/h4-6H,2-3,7H2,1H3/t4-,5+,6-/m1/s1
InChIKeyKJSBEEMANSIKPH-NGJCXOISSA-N
XLogP0.34
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

Analyze (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine with MolForge

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Related Compounds

2-Propan-2-ylpyrrolidin-1-amine
CID 19691257
3-Azabicyclo[3.1.0]hexan-3-amine
CID 56972758
(2R,4S)-2,4-dimethylpyrrolidin-1-amine
CID 67681309
(3R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine
CID 67681747
(3R)-3-iodo-2-azabicyclo[3.1.0]hexan-2-amine
CID 67681776
2,4-Dimethylpyrrolidin-1-amine
CID 77335194
3-Methyl-2-azabicyclo[3.1.0]hexan-2-amine
CID 77335199
2,5-Dimethylpiperidin-1-amine
CID 80034842
2-Cyclopropylpyrrolidin-1-amine
CID 83528724
(1R,3R,4S)-3-methyl-2-azabicyclo[2.2.1]heptan-2-amine
CID 89010700
(2R)-2-methyl-3-azabicyclo[3.1.0]hexan-3-amine
CID 89010723
(5R)-5-methyl-4-azaspiro[2.4]heptan-4-amine
CID 89010880

Frequently Asked Questions

What is the IUPAC name of (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine?
The IUPAC name of (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine (CID 67681325) is (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine.
What is the SMILES notation for (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine?
The canonical SMILES for (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine is C[C@@H]1C[C@H]2C[C@H]2N1N.
What is the InChIKey of (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine?
The InChIKey is KJSBEEMANSIKPH-NGJCXOISSA-N. The full InChI is InChI=1S/C6H12N2/c1-4-2-5-3-6(5)8(4)7/h4-6H,2-3,7H2,1H3/t4-,5+,6-/m1/s1.
What are the key properties of (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine?
(1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine has a molecular weight of 112.18 g/mol, XLogP of 0.34, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3R,5R)-3-methyl-2-azabicyclo[3.1.0]hexan-2-amine is sourced from PubChem (CID 67681325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).