1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride

C18H22ClN — CID 175161324

IUPAC1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
SMILESC[C@@H](c1ccccc1)C1c2ccccc2CCC1N.Cl
InChIInChI=1S/C18H21N.ClH/c1-13(14-7-3-2-4-8-14)18-16-10-6-5-9-15(16)11-12-17(18)19;/h2-10,13,17-18H,11-12,19H2,1H3;1H/t13-,17?,18?;/m0./s1
InChIKeyAUIWIGVEFWZFGT-TVIPZRLESA-N
MW287.83 g/mol
LogP4.27
Rot. Bonds2

About 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride

1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride (PubChem CID 175161324) has the molecular formula C18H22ClN and a molecular weight of 287.83 g/mol. Its IUPAC name is 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride.

Molecular Properties

Compound Name1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
PubChem CID175161324
Molecular FormulaC18H22ClN
Molecular Weight287.83 g/mol
Exact Mass287.14
IUPAC Name1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
SMILESC[C@@H](c1ccccc1)C1c2ccccc2CCC1N.Cl
InChIInChI=1S/C18H21N.ClH/c1-13(14-7-3-2-4-8-14)18-16-10-6-5-9-15(16)11-12-17(18)19;/h2-10,13,17-18H,11-12,19H2,1H3;1H/t13-,17?,18?;/m0./s1
InChIKeyAUIWIGVEFWZFGT-TVIPZRLESA-N
XLogP4.27
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.83
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S,2S)-2-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 157427807
2,3-dihydro-1H-inden-1-amine;methanamine
CID 174570832
1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 23332534
(1S)-2,3-dihydro-1H-inden-1-amine
CID 7000084
(1R)-1-propan-2-yl-2,3-dihydro-1H-indene
CID 59961726
(1R,2S)-2-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 118421434
(1R,2S)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol;hydrochloride
CID 172885282
N-methyl-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 18627798
2-phenylethylbenzene;1-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene;toluene
CID 173264827
3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)butan-2-ol
CID 63902024
N-[(1S)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 78956142
2-(3-propan-2-ylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43103826

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride?
The IUPAC name of 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride (CID 175161324) is 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride.
What is the SMILES notation for 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride?
The canonical SMILES for 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride is C[C@@H](c1ccccc1)C1c2ccccc2CCC1N.Cl.
What is the InChIKey of 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride?
The InChIKey is AUIWIGVEFWZFGT-TVIPZRLESA-N. The full InChI is InChI=1S/C18H21N.ClH/c1-13(14-7-3-2-4-8-14)18-16-10-6-5-9-15(16)11-12-17(18)19;/h2-10,13,17-18H,11-12,19H2,1H3;1H/t13-,17?,18?;/m0./s1.
What are the key properties of 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride?
1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride has a molecular weight of 287.83 g/mol, XLogP of 4.27, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride is sourced from PubChem (CID 175161324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).