[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride

C11H16ClN — CID 171991657

IUPAC[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride
SMILESCl.NC[C@H]1CCCc2ccccc21
InChIInChI=1S/C11H15N.ClH/c12-8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-2,4,7,10H,3,5-6,8,12H2;1H/t10-;/m1./s1
InChIKeyGIRBHZUXYMPUEY-HNCPQSOCSA-N
MW197.71 g/mol
LogP2.49
Rot. Bonds1

About [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride

[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride (PubChem CID 171991657) has the molecular formula C11H16ClN and a molecular weight of 197.71 g/mol. Its IUPAC name is [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride.

Molecular Properties

Compound Name[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride
PubChem CID171991657
Molecular FormulaC11H16ClN
Molecular Weight197.71 g/mol
Exact Mass197.10
IUPAC Name[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride
SMILESCl.NC[C@H]1CCCc2ccccc21
InChIInChI=1S/C11H15N.ClH/c12-8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-2,4,7,10H,3,5-6,8,12H2;1H/t10-;/m1./s1
InChIKeyGIRBHZUXYMPUEY-HNCPQSOCSA-N
XLogP2.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.71
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride 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

1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 15742901
1-(iodomethyl)-1,2,3,4-tetrahydronaphthalene
CID 2763030
1-(bromomethyl)-1,2,3,4-tetrahydronaphthalene
CID 13067239
[2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cycloheptyl]methanamine
CID 81010954
1,2,3,4-tetrahydroanthracen-1-ylmethanamine
CID 151662391
1,3,4,5-tetrahydro-2-benzoxepin-5-ylmethanamine;hydrochloride
CID 165145940
[(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride
CID 66651510
2-(1,2,3,4-tetrahydronaphthalen-1-ylmethylsulfanyl)ethanamine
CID 63772452
N'-(2-aminoethyl)-N'-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)ethane-1,2-diamine
CID 55242274
1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
CID 54453127
(1R)-1-prop-2-enyl-1,2,3,4-tetrahydronaphthalene
CID 138977422
1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine
CID 63772469

Frequently Asked Questions

What is the IUPAC name of [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride?
The IUPAC name of [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride (CID 171991657) is [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride.
What is the SMILES notation for [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride?
The canonical SMILES for [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride is Cl.NC[C@H]1CCCc2ccccc21.
What is the InChIKey of [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride?
The InChIKey is GIRBHZUXYMPUEY-HNCPQSOCSA-N. The full InChI is InChI=1S/C11H15N.ClH/c12-8-10-6-3-5-9-4-1-2-7-11(9)10;/h1-2,4,7,10H,3,5-6,8,12H2;1H/t10-;/m1./s1.
What are the key properties of [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride?
[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride has a molecular weight of 197.71 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride is sourced from PubChem (CID 171991657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).