(1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol

C10H13NO — CID 11084208

IUPAC(1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol
SMILESN[C@H]1c2ccccc2CC[C@H]1O
InChIInChI=1S/C10H13NO/c11-10-8-4-2-1-3-7(8)5-6-9(10)12/h1-4,9-10,12H,5-6,11H2/t9-,10+/m1/s1
InChIKeyNBUGQUVHXNWCTQ-ZJUUUORDSA-N
MW163.22 g/mol
LogP0.99
Rot. Bonds

About (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol

(1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol (PubChem CID 11084208) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name(1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol
PubChem CID11084208
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name(1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol
SMILESN[C@H]1c2ccccc2CC[C@H]1O
InChIInChI=1S/C10H13NO/c11-10-8-4-2-1-3-7(8)5-6-9(10)12/h1-4,9-10,12H,5-6,11H2/t9-,10+/m1/s1
InChIKeyNBUGQUVHXNWCTQ-ZJUUUORDSA-N
XLogP0.99
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol?
The IUPAC name of (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol (CID 11084208) is (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol.
What is the SMILES notation for (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol?
The canonical SMILES for (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol is N[C@H]1c2ccccc2CC[C@H]1O.
What is the InChIKey of (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol?
The InChIKey is NBUGQUVHXNWCTQ-ZJUUUORDSA-N. The full InChI is InChI=1S/C10H13NO/c11-10-8-4-2-1-3-7(8)5-6-9(10)12/h1-4,9-10,12H,5-6,11H2/t9-,10+/m1/s1.
What are the key properties of (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol?
(1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol has a molecular weight of 163.22 g/mol, XLogP of 0.99, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R)-1-amino-1,2,3,4-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 11084208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).