(1R)-2-azabicyclo[2.2.1]heptane

C6H11N — CID 69264533

IUPAC(1R)-2-azabicyclo[2.2.1]heptane
SMILESC1C[C@@H]2CC1CN2
InChIInChI=1S/C6H11N/c1-2-6-3-5(1)4-7-6/h5-7H,1-4H2/t5?,6-/m1/s1
InChIKeyGYLMCBOAXJVARF-PRJDIBJQSA-N
MW97.16 g/mol
LogP0.76
Rot. Bonds

About (1R)-2-azabicyclo[2.2.1]heptane

(1R)-2-azabicyclo[2.2.1]heptane (PubChem CID 69264533) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is (1R)-2-azabicyclo[2.2.1]heptane.

Molecular Properties

Compound Name(1R)-2-azabicyclo[2.2.1]heptane
PubChem CID69264533
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC Name(1R)-2-azabicyclo[2.2.1]heptane
SMILESC1C[C@@H]2CC1CN2
InChIInChI=1S/C6H11N/c1-2-6-3-5(1)4-7-6/h5-7H,1-4H2/t5?,6-/m1/s1
InChIKeyGYLMCBOAXJVARF-PRJDIBJQSA-N
XLogP0.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Azabicyclo(2.2.1)heptane
CID 78963
2-Azabicyclo[2.2.1]heptane hydrochloride
CID 20070801
(1S,4R)-2-azabicyclo[2.2.1]heptane hydrochloride
CID 13078200
2-Methyl-2-azabicyclo[2.2.1]heptan-5-amine
CID 20271678
2-(2-Azabicyclo(2.2.1)heptan-2-yl)ethan-1-amine
CID 57640033
1-Methyl-2-azabicyclo[2.2.1]heptane
CID 66970177
5,5-Difluoro-2-azabicyclo(2.2.1)heptane hydrochloride
CID 84717355
(1R,4S)-2-azabicyclo(2.2.1)heptane hydrochloride
CID 122163564
6,6-Difluoro-2-azabicyclo(2.2.1)heptane hydrochloride
CID 127264201
(1R,3S,4S)-3-(trifluoromethyl)-2-azabicyclo(2.2.1)heptane hydrochloride
CID 145867377
4-Methyl-2-azabicyclo(2.2.1)heptane hydrochloride
CID 165891429
rac-(1R,4R,5R)-5-methyl-2-azabicyclo[2.2.1]heptane hydrochloride
CID 165979404

Frequently Asked Questions

What is the IUPAC name of (1R)-2-azabicyclo[2.2.1]heptane?
The IUPAC name of (1R)-2-azabicyclo[2.2.1]heptane (CID 69264533) is (1R)-2-azabicyclo[2.2.1]heptane.
What is the SMILES notation for (1R)-2-azabicyclo[2.2.1]heptane?
The canonical SMILES for (1R)-2-azabicyclo[2.2.1]heptane is C1C[C@@H]2CC1CN2.
What is the InChIKey of (1R)-2-azabicyclo[2.2.1]heptane?
The InChIKey is GYLMCBOAXJVARF-PRJDIBJQSA-N. The full InChI is InChI=1S/C6H11N/c1-2-6-3-5(1)4-7-6/h5-7H,1-4H2/t5?,6-/m1/s1.
What are the key properties of (1R)-2-azabicyclo[2.2.1]heptane?
(1R)-2-azabicyclo[2.2.1]heptane has a molecular weight of 97.16 g/mol, XLogP of 0.76, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-azabicyclo[2.2.1]heptane is sourced from PubChem (CID 69264533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).