(1S)-2-amino-1-quinolin-2-ylethanol

C11H12N2O — CID 96808696

IUPAC(1S)-2-amino-1-quinolin-2-ylethanol
SMILESNC[C@H](O)c1ccc2ccccc2n1
InChIInChI=1S/C11H12N2O/c12-7-11(14)10-6-5-8-3-1-2-4-9(8)13-10/h1-6,11,14H,7,12H2/t11-/m0/s1
InChIKeyRFLZEZFRSSLLST-NSHDSACASA-N
MW188.23 g/mol
LogP1.23
Rot. Bonds2

About (1S)-2-amino-1-quinolin-2-ylethanol

(1S)-2-amino-1-quinolin-2-ylethanol (PubChem CID 96808696) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is (1S)-2-amino-1-quinolin-2-ylethanol.

Molecular Properties

Compound Name(1S)-2-amino-1-quinolin-2-ylethanol
PubChem CID96808696
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name(1S)-2-amino-1-quinolin-2-ylethanol
SMILESNC[C@H](O)c1ccc2ccccc2n1
InChIInChI=1S/C11H12N2O/c12-7-11(14)10-6-5-8-3-1-2-4-9(8)13-10/h1-6,11,14H,7,12H2/t11-/m0/s1
InChIKeyRFLZEZFRSSLLST-NSHDSACASA-N
XLogP1.23
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

amino(quinolin-2-yl)methanol
CID 154237779
ethyl 3-hydroxy-3-quinolin-2-ylpropanoate
CID 59168927
4-amino-1-quinolin-2-ylbutane-1,2-diol
CID 171881473
4-amino-3-quinolin-2-ylbutan-1-ol
CID 66089092
3-amino-2,2-dimethyl-1-quinolin-2-ylpropan-1-ol
CID 79125016
2-(furan-3-yl)-1-quinolin-2-ylethanol
CID 83172429
(3S)-3-amino-3-quinolin-2-ylpropan-1-ol
CID 96860354
(1R)-1-quinolin-2-ylbutane-1,4-diamine
CID 171216930
(1S)-1-quinolin-2-ylbutane-1,4-diamine
CID 171236567
2-pyridin-3-yl-1-quinolin-2-ylethanol
CID 104735737
(1S)-2-(tert-butylamino)-1-quinolin-2-ylethanol;sulfane
CID 159416037
2-amino-1-quinolin-2-ylbutan-1-ol
CID 64955097

Frequently Asked Questions

What is the IUPAC name of (1S)-2-amino-1-quinolin-2-ylethanol?
The IUPAC name of (1S)-2-amino-1-quinolin-2-ylethanol (CID 96808696) is (1S)-2-amino-1-quinolin-2-ylethanol.
What is the SMILES notation for (1S)-2-amino-1-quinolin-2-ylethanol?
The canonical SMILES for (1S)-2-amino-1-quinolin-2-ylethanol is NC[C@H](O)c1ccc2ccccc2n1.
What is the InChIKey of (1S)-2-amino-1-quinolin-2-ylethanol?
The InChIKey is RFLZEZFRSSLLST-NSHDSACASA-N. The full InChI is InChI=1S/C11H12N2O/c12-7-11(14)10-6-5-8-3-1-2-4-9(8)13-10/h1-6,11,14H,7,12H2/t11-/m0/s1.
What are the key properties of (1S)-2-amino-1-quinolin-2-ylethanol?
(1S)-2-amino-1-quinolin-2-ylethanol has a molecular weight of 188.23 g/mol, XLogP of 1.23, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-amino-1-quinolin-2-ylethanol is sourced from PubChem (CID 96808696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).