(1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine

C7H14N2 — CID 131858389

IUPAC(1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine
SMILESCC1[C@H]2CNC[C@@H]1C2N
InChIInChI=1S/C7H14N2/c1-4-5-2-9-3-6(4)7(5)8/h4-7,9H,2-3,8H2,1H3/t4?,5-,6+,7?
InChIKeyWOXHLXZZRRPIRJ-ICQZWEGKSA-N
MW126.20 g/mol
LogP-0.20
Rot. Bonds

About (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine

(1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine (PubChem CID 131858389) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine.

Molecular Properties

Compound Name(1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine
PubChem CID131858389
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name(1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine
SMILESCC1[C@H]2CNC[C@@H]1C2N
InChIInChI=1S/C7H14N2/c1-4-5-2-9-3-6(4)7(5)8/h4-7,9H,2-3,8H2,1H3/t4?,5-,6+,7?
InChIKeyWOXHLXZZRRPIRJ-ICQZWEGKSA-N
XLogP-0.20
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-dimethylpiperidin-4-amine
CID 10171243
(3R,4S)-4-methylpyrrolidin-3-amine;dihydrochloride
CID 25178690
ethane;3-methylazetidine
CID 90730870
(3R,5S)-5-methylpiperidin-3-amine
CID 90290401
(1S,5R)-8-methyl-3-azabicyclo[3.2.1]octane
CID 139316349
3-azabicyclo[3.2.1]octan-8-amine
CID 18540942
6-methyl-3-azabicyclo[3.1.0]hexan-2-amine
CID 166127806
ethane;8-methyl-3-azabicyclo[3.2.1]octane
CID 155722306
(1R,5S)-6-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane
CID 39872416
6-iodo-3-azabicyclo[3.1.0]hexane
CID 130360842
8-methylbicyclo[4.2.0]octan-7-amine
CID 81421667
ethene;6-methyl-3-azabicyclo[3.1.1]heptane
CID 164585324

Frequently Asked Questions

What is the IUPAC name of (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine?
The IUPAC name of (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine (CID 131858389) is (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine.
What is the SMILES notation for (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine?
The canonical SMILES for (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine is CC1[C@H]2CNC[C@@H]1C2N.
What is the InChIKey of (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine?
The InChIKey is WOXHLXZZRRPIRJ-ICQZWEGKSA-N. The full InChI is InChI=1S/C7H14N2/c1-4-5-2-9-3-6(4)7(5)8/h4-7,9H,2-3,8H2,1H3/t4?,5-,6+,7?.
What are the key properties of (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine?
(1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine has a molecular weight of 126.20 g/mol, XLogP of -0.20, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine is sourced from PubChem (CID 131858389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).