(5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine

C8H16N2 — CID 146238903

IUPAC(5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CC[C@H]1CC(N)C2
InChIInChI=1S/C8H16N2/c1-10-7-2-3-8(10)5-6(9)4-7/h6-8H,2-5,9H2,1H3/t6?,7-,8?/m0/s1
InChIKeyHJGMRAKQWLKWMH-WTIBDHCWSA-N
MW140.23 g/mol
LogP0.57
Rot. Bonds

About (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine

(5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 146238903) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name(5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID146238903
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CC[C@H]1CC(N)C2
InChIInChI=1S/C8H16N2/c1-10-7-2-3-8(10)5-6(9)4-7/h6-8H,2-5,9H2,1H3/t6?,7-,8?/m0/s1
InChIKeyHJGMRAKQWLKWMH-WTIBDHCWSA-N
XLogP0.57
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R,3R)-9-methyl-9-azabicyclo[4.2.1]nonan-3-amine
CID 174018947
(1S,5R)-3,9-dimethyl-3,9-diazabicyclo[3.3.1]nonan-7-amine
CID 66874073
ethane;(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine;8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine
CID 166167498
(1R,3R)-6-methyl-6-azabicyclo[3.2.2]nonan-3-amine
CID 129230742
(1R,5R)-3-chloro-8-methyl-8-azabicyclo[3.2.1]octane
CID 98059828
(1R)-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
CID 104932140
(5R)-6-methyl-6-azabicyclo[3.1.1]heptane
CID 176941052
8-(2-aminoethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 70332467
8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)disulfanyl]-8-azabicyclo[3.2.1]octane
CID 140763000
1-[(1R,5S)-3-amino-8-azabicyclo[3.2.1]octan-8-yl]-2,2-difluoroethanone
CID 130905866
(1R,3S,5R)-8-methyl-6-methylidene-8-azabicyclo[3.2.1]octan-3-amine
CID 154939012
8-(2-methylsulfanylethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 63960241

Frequently Asked Questions

What is the IUPAC name of (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine (CID 146238903) is (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine is CN1C2CC[C@H]1CC(N)C2.
What is the InChIKey of (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is HJGMRAKQWLKWMH-WTIBDHCWSA-N. The full InChI is InChI=1S/C8H16N2/c1-10-7-2-3-8(10)5-6(9)4-7/h6-8H,2-5,9H2,1H3/t6?,7-,8?/m0/s1.
What are the key properties of (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
(5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 140.23 g/mol, XLogP of 0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 146238903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).