(5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol

C12H17NO — CID 131096656

IUPAC(5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCCc1ccc(O)c2c1[C@@H](N)CCC2
InChIInChI=1S/C12H17NO/c1-2-8-6-7-11(14)9-4-3-5-10(13)12(8)9/h6-7,10,14H,2-5,13H2,1H3/t10-/m0/s1
InChIKeyGEMGRGCVOXGBSZ-JTQLQIEISA-N
MW191.27 g/mol
LogP2.29
Rot. Bonds1

About (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol

(5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol (PubChem CID 131096656) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name(5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol
PubChem CID131096656
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name(5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCCc1ccc(O)c2c1[C@@H](N)CCC2
InChIInChI=1S/C12H17NO/c1-2-8-6-7-11(14)9-4-3-5-10(13)12(8)9/h6-7,10,14H,2-5,13H2,1H3/t10-/m0/s1
InChIKeyGEMGRGCVOXGBSZ-JTQLQIEISA-N
XLogP2.29
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-5-bromo-8-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130985321
(1R)-5-ethyl-8-fluoro-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130691697
(1S)-7-ethyl-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 131145871
(5-amino-4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)methanol
CID 130044029
5-ethyl-8-(4-methylpiperazin-1-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 151605178
(5S)-1,4-diethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
CID 79014213
3-cyclohexyl-4-ethylbenzene-1,2-diol
CID 154435911
(1R)-1-amino-7-chloro-2,3-dihydro-1H-inden-4-ol
CID 55278137
(1R)-1-amino-7-bromo-2,3-dihydro-1H-inden-4-ol
CID 130647724
8-ethyl-1-methyl-3,4-dihydro-2H-quinolin-5-ol
CID 145312630
(4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol
CID 130699791
(8R)-8-amino-5,6,7,8-tetrahydronaphthalen-1-ol
CID 130673743

Frequently Asked Questions

What is the IUPAC name of (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol?
The IUPAC name of (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol (CID 131096656) is (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol.
What is the SMILES notation for (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol?
The canonical SMILES for (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol is CCc1ccc(O)c2c1[C@@H](N)CCC2.
What is the InChIKey of (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol?
The InChIKey is GEMGRGCVOXGBSZ-JTQLQIEISA-N. The full InChI is InChI=1S/C12H17NO/c1-2-8-6-7-11(14)9-4-3-5-10(13)12(8)9/h6-7,10,14H,2-5,13H2,1H3/t10-/m0/s1.
What are the key properties of (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol?
(5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol has a molecular weight of 191.27 g/mol, XLogP of 2.29, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 131096656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).