azane;(1R)-1-phenylethanol

C8H13NO — CID 126646564

IUPACazane;(1R)-1-phenylethanol
SMILESC[C@@H](O)c1ccccc1.N
InChIInChI=1S/C8H10O.H3N/c1-7(9)8-5-3-2-4-6-8;/h2-7,9H,1H3;1H3/t7-;/m1./s1
InChIKeyJYZIFKMDXJSPIZ-OGFXRTJISA-N
MW139.20 g/mol
LogP1.90
Rot. Bonds1

About azane;(1R)-1-phenylethanol

azane;(1R)-1-phenylethanol (PubChem CID 126646564) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is azane;(1R)-1-phenylethanol.

Molecular Properties

Compound Nameazane;(1R)-1-phenylethanol
PubChem CID126646564
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Nameazane;(1R)-1-phenylethanol
SMILESC[C@@H](O)c1ccccc1.N
InChIInChI=1S/C8H10O.H3N/c1-7(9)8-5-3-2-4-6-8;/h2-7,9H,1H3;1H3/t7-;/m1./s1
InChIKeyJYZIFKMDXJSPIZ-OGFXRTJISA-N
XLogP1.90
TPSA55.23 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-phenylethanol
CID 157125626
carbanide;(1R)-1-phenylethanol;zinc
CID 177390370
2-methylpropan-2-ol;1-phenylethanol
CID 160949043
2,3-dimethylbutane-2,3-diol;1-phenylethanol
CID 67631199
nitric acid;1-phenylethanol
CID 67855225
2,2,2-trideuterio-1-phenylethanol
CID 15618819
1-[3-(2-phenylphenyl)phenyl]ethanol
CID 70377718
(1R)-1-[3-[3-[(1R)-1-hydroxyethyl]phenyl]phenyl]ethanol
CID 15321486
cumene;hydrogen peroxide
CID 21225480
1-(4-phenoxyphenyl)ethanol;hydrochloride
CID 67663526
azane;cumene;hydrochloride
CID 175202155
ethenyl acetate;1-phenylethanol
CID 170349745

Frequently Asked Questions

What is the IUPAC name of azane;(1R)-1-phenylethanol?
The IUPAC name of azane;(1R)-1-phenylethanol (CID 126646564) is azane;(1R)-1-phenylethanol.
What is the SMILES notation for azane;(1R)-1-phenylethanol?
The canonical SMILES for azane;(1R)-1-phenylethanol is C[C@@H](O)c1ccccc1.N.
What is the InChIKey of azane;(1R)-1-phenylethanol?
The InChIKey is JYZIFKMDXJSPIZ-OGFXRTJISA-N. The full InChI is InChI=1S/C8H10O.H3N/c1-7(9)8-5-3-2-4-6-8;/h2-7,9H,1H3;1H3/t7-;/m1./s1.
What are the key properties of azane;(1R)-1-phenylethanol?
azane;(1R)-1-phenylethanol has a molecular weight of 139.20 g/mol, XLogP of 1.90, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;(1R)-1-phenylethanol is sourced from PubChem (CID 126646564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).