[(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine

C9H17N — CID 166698181

IUPAC[(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine
SMILESC[C@H]1C2CCC(CN)[C@@H]1C2
InChIInChI=1S/C9H17N/c1-6-7-2-3-8(5-10)9(6)4-7/h6-9H,2-5,10H2,1H3/t6-,7?,8?,9+/m0/s1
InChIKeyRUXCNGMDYHUHBV-DFAZKQQPSA-N
MW139.24 g/mol
LogP1.63
Rot. Bonds1

About [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine

[(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine (PubChem CID 166698181) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine.

Molecular Properties

Compound Name[(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine
PubChem CID166698181
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name[(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine
SMILESC[C@H]1C2CCC(CN)[C@@H]1C2
InChIInChI=1S/C9H17N/c1-6-7-2-3-8(5-10)9(6)4-7/h6-9H,2-5,10H2,1H3/t6-,7?,8?,9+/m0/s1
InChIKeyRUXCNGMDYHUHBV-DFAZKQQPSA-N
XLogP1.63
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine 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

[(1S)-2,3-dimethylcyclopentyl]methanamine
CID 129279891
[2-(4-methylcyclohexyl)cyclohexyl]methanamine
CID 81010575
[2-(4-methylcyclohexyl)cyclopentyl]methanamine
CID 81011106
1,2,3,3a,4,5,6,6a-octahydropentalen-1-ylmethanamine;hydrochloride
CID 170922777
2-(aminomethyl)-5-methylcyclohexan-1-amine
CID 62070304
(1R,3S,4S)-2,3-dimethylbicyclo[2.2.1]heptane
CID 91107187
[2-(aminomethyl)cyclobutyl]methanamine;hydrochloride
CID 175788563
(1R,3R,4S)-2,3-dimethylbicyclo[2.2.1]heptane
CID 163414856
(1S,4R)-5-methylbicyclo[2.1.1]hexane
CID 154518789
[4-tert-butyl-2-(3-methylcyclohexyl)cyclohexyl]methanamine
CID 81011858
[2-(2-bicyclo[2.2.1]heptanyl)-4-ethylcyclohexyl]methanamine
CID 114246999
(1R,2R)-3-cyclopropyl-2-methylbicyclo[3.1.0]hexane
CID 163692624

Frequently Asked Questions

What is the IUPAC name of [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine?
The IUPAC name of [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine (CID 166698181) is [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine.
What is the SMILES notation for [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine?
The canonical SMILES for [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine is C[C@H]1C2CCC(CN)[C@@H]1C2.
What is the InChIKey of [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine?
The InChIKey is RUXCNGMDYHUHBV-DFAZKQQPSA-N. The full InChI is InChI=1S/C9H17N/c1-6-7-2-3-8(5-10)9(6)4-7/h6-9H,2-5,10H2,1H3/t6-,7?,8?,9+/m0/s1.
What are the key properties of [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine?
[(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine has a molecular weight of 139.24 g/mol, XLogP of 1.63, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,6S)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanamine is sourced from PubChem (CID 166698181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).