(1R)-1-(3-aminophenyl)ethanol

C8H11NO — CID 643191

IUPAC(1R)-1-(3-aminophenyl)ethanol
SMILESC[C@@H](O)c1cccc(N)c1
InChIInChI=1S/C8H11NO/c1-6(10)7-3-2-4-8(9)5-7/h2-6,10H,9H2,1H3/t6-/m1/s1
InChIKeyQPKNDHZQPGMLCJ-ZCFIWIBFSA-N
MW137.18 g/mol
LogP1.32
Rot. Bonds1

About (1R)-1-(3-aminophenyl)ethanol

(1R)-1-(3-aminophenyl)ethanol (PubChem CID 643191) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is (1R)-1-(3-aminophenyl)ethanol.

Molecular Properties

Compound Name(1R)-1-(3-aminophenyl)ethanol
PubChem CID643191
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name(1R)-1-(3-aminophenyl)ethanol
SMILESC[C@@H](O)c1cccc(N)c1
InChIInChI=1S/C8H11NO/c1-6(10)7-3-2-4-8(9)5-7/h2-6,10H,9H2,1H3/t6-/m1/s1
InChIKeyQPKNDHZQPGMLCJ-ZCFIWIBFSA-N
XLogP1.32
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

CID 21439
CID 21439
CID 9838763
CID 9838763
CID 69331
CID 69331
CID 222461
CID 222461
CID 102330434
CID 102330434
CID 79282
CID 79282
CID 66904
CID 66904
CID 4313746
CID 4313746
CID 80293
CID 80293
CID 223135
CID 223135
CID 270810
CID 270810
CID 9815235
CID 9815235

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(3-aminophenyl)ethanol?
The IUPAC name of (1R)-1-(3-aminophenyl)ethanol (CID 643191) is (1R)-1-(3-aminophenyl)ethanol.
What is the SMILES notation for (1R)-1-(3-aminophenyl)ethanol?
The canonical SMILES for (1R)-1-(3-aminophenyl)ethanol is C[C@@H](O)c1cccc(N)c1.
What is the InChIKey of (1R)-1-(3-aminophenyl)ethanol?
The InChIKey is QPKNDHZQPGMLCJ-ZCFIWIBFSA-N. The full InChI is InChI=1S/C8H11NO/c1-6(10)7-3-2-4-8(9)5-7/h2-6,10H,9H2,1H3/t6-/m1/s1.
What are the key properties of (1R)-1-(3-aminophenyl)ethanol?
(1R)-1-(3-aminophenyl)ethanol has a molecular weight of 137.18 g/mol, XLogP of 1.32, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(3-aminophenyl)ethanol is sourced from PubChem (CID 643191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).