2-amino-2,3-dihydro-1,3-benzoxazol-6-ol

C7H8N2O2 — CID 135257276

IUPAC2-amino-2,3-dihydro-1,3-benzoxazol-6-ol
SMILESNC1Nc2ccc(O)cc2O1
InChIInChI=1S/C7H8N2O2/c8-7-9-5-2-1-4(10)3-6(5)11-7/h1-3,7,9-10H,8H2
InChIKeyJFPZWPXTCMXPKL-UHFFFAOYSA-N
MW152.15 g/mol
LogP0.44
Rot. Bonds

About 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol

2-amino-2,3-dihydro-1,3-benzoxazol-6-ol (PubChem CID 135257276) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol.

Molecular Properties

Compound Name2-amino-2,3-dihydro-1,3-benzoxazol-6-ol
PubChem CID135257276
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name2-amino-2,3-dihydro-1,3-benzoxazol-6-ol
SMILESNC1Nc2ccc(O)cc2O1
InChIInChI=1S/C7H8N2O2/c8-7-9-5-2-1-4(10)3-6(5)11-7/h1-3,7,9-10H,8H2
InChIKeyJFPZWPXTCMXPKL-UHFFFAOYSA-N
XLogP0.44
TPSA67.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 50.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-3,4-dihydro-2H-1,4-benzoxazin-7-ol
CID 69369715
5-fluoro-2,3-dihydro-1,3-benzoxazol-2-amine
CID 164602655
4-amino-9-hydroxy-2,3,4,6-tetrahydro-1,6-benzoxazocin-5-one
CID 117246887
7-hydroxy-10,10a-dihydrophenoxazin-3-one
CID 15764374
(4R)-4-amino-1,2,3,4-tetrahydroquinolin-6-ol
CID 118989908
2-[(2,5-dimethylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazin-7-ol
CID 82228774
(4S)-4-amino-3,4-dihydro-2H-chromen-7-ol;hydrochloride
CID 171252096
2-[(3-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazin-7-ol
CID 82228787
6-tert-butyl-2,3-dihydro-1,3-benzoxazol-2-ol
CID 134479038
9-amino-9H-xanthen-3-ol
CID 10443193
4-fluoro-1,2,3,4-tetrahydroquinolin-6-ol
CID 84717188
spiro[3,4-dihydro-1,4-benzoxazine-2,1'-cyclohexane]-7-ol
CID 115098139

Frequently Asked Questions

What is the IUPAC name of 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol?
The IUPAC name of 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol (CID 135257276) is 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol.
What is the SMILES notation for 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol?
The canonical SMILES for 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol is NC1Nc2ccc(O)cc2O1.
What is the InChIKey of 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol?
The InChIKey is JFPZWPXTCMXPKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c8-7-9-5-2-1-4(10)3-6(5)11-7/h1-3,7,9-10H,8H2.
What are the key properties of 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol?
2-amino-2,3-dihydro-1,3-benzoxazol-6-ol has a molecular weight of 152.15 g/mol, XLogP of 0.44, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2,3-dihydro-1,3-benzoxazol-6-ol is sourced from PubChem (CID 135257276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).