[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium

C10H14N+ — CID 40572503

IUPAC[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium
SMILES[NH3+][C@H]1CCc2ccccc2C1
InChIInChI=1S/C10H13N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-4,10H,5-7,11H2/p+1/t10-/m0/s1
InChIKeyLCGFVWKNXLRFIF-JTQLQIEISA-O
MW148.23 g/mol
LogP0.79
Rot. Bonds

About [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium

[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium (PubChem CID 40572503) has the molecular formula C10H14N+ and a molecular weight of 148.23 g/mol. Its IUPAC name is [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium.

Molecular Properties

Compound Name[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium
PubChem CID40572503
Molecular FormulaC10H14N+
Molecular Weight148.23 g/mol
Exact Mass148.11
IUPAC Name[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium
SMILES[NH3+][C@H]1CCc2ccccc2C1
InChIInChI=1S/C10H13N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-4,10H,5-7,11H2/p+1/t10-/m0/s1
InChIKeyLCGFVWKNXLRFIF-JTQLQIEISA-O
XLogP0.79
TPSA27.64 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.23
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

benzene;1,2,3,4-tetrahydronaphthalen-2-amine
CID 66647094
1,2,3,4-tetrahydronaphthalen-2-amine;trihydrochloride
CID 67686398
2-ethenyl-1,2,3,4-tetrahydronaphthalene
CID 18314182
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine
CID 86313684
(6S,7S)-7-amino-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ol
CID 53322291
ethane;2-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 142915182
2-(2-bromoethyl)-1,2,3,4-tetrahydronaphthalene
CID 15752629
7-bicyclo[4.2.0]octa-1,3,5-trienylazanium
CID 4235727
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl] methanesulfonate
CID 124600614
1,2,3,4-tetrahydronaphthalene-2-carboxylic acid;hydrochloride
CID 67808987
2-propyl-1,2,3,4-tetrahydronaphthalene
CID 13330225
2-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]pyrimidine
CID 68856082

Frequently Asked Questions

What is the IUPAC name of [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium?
The IUPAC name of [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium (CID 40572503) is [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium.
What is the SMILES notation for [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium?
The canonical SMILES for [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium is [NH3+][C@H]1CCc2ccccc2C1.
What is the InChIKey of [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium?
The InChIKey is LCGFVWKNXLRFIF-JTQLQIEISA-O. The full InChI is InChI=1S/C10H13N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-4,10H,5-7,11H2/p+1/t10-/m0/s1.
What are the key properties of [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium?
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium has a molecular weight of 148.23 g/mol, XLogP of 0.79, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium is sourced from PubChem (CID 40572503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).