4-[(2R)-2-(hydroxyamino)propyl]phenol

C9H13NO2 — CID 91205660

IUPAC4-[(2R)-2-(hydroxyamino)propyl]phenol
SMILESC[C@H](Cc1ccc(O)cc1)NO
InChIInChI=1S/C9H13NO2/c1-7(10-12)6-8-2-4-9(11)5-3-8/h2-5,7,10-12H,6H2,1H3/t7-/m1/s1
InChIKeyYMPLTIYOSUKSPT-SSDOTTSWSA-N
MW167.21 g/mol
LogP1.30
Rot. Bonds3

About 4-[(2R)-2-(hydroxyamino)propyl]phenol

4-[(2R)-2-(hydroxyamino)propyl]phenol (PubChem CID 91205660) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 4-[(2R)-2-(hydroxyamino)propyl]phenol.

Molecular Properties

Compound Name4-[(2R)-2-(hydroxyamino)propyl]phenol
PubChem CID91205660
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name4-[(2R)-2-(hydroxyamino)propyl]phenol
SMILESC[C@H](Cc1ccc(O)cc1)NO
InChIInChI=1S/C9H13NO2/c1-7(10-12)6-8-2-4-9(11)5-3-8/h2-5,7,10-12H,6H2,1H3/t7-/m1/s1
InChIKeyYMPLTIYOSUKSPT-SSDOTTSWSA-N
XLogP1.30
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-2-(hydroxyamino)propyl]phenol?
The IUPAC name of 4-[(2R)-2-(hydroxyamino)propyl]phenol (CID 91205660) is 4-[(2R)-2-(hydroxyamino)propyl]phenol.
What is the SMILES notation for 4-[(2R)-2-(hydroxyamino)propyl]phenol?
The canonical SMILES for 4-[(2R)-2-(hydroxyamino)propyl]phenol is C[C@H](Cc1ccc(O)cc1)NO.
What is the InChIKey of 4-[(2R)-2-(hydroxyamino)propyl]phenol?
The InChIKey is YMPLTIYOSUKSPT-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H13NO2/c1-7(10-12)6-8-2-4-9(11)5-3-8/h2-5,7,10-12H,6H2,1H3/t7-/m1/s1.
What are the key properties of 4-[(2R)-2-(hydroxyamino)propyl]phenol?
4-[(2R)-2-(hydroxyamino)propyl]phenol has a molecular weight of 167.21 g/mol, XLogP of 1.30, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-2-(hydroxyamino)propyl]phenol is sourced from PubChem (CID 91205660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).