2H-2-benzazepin-4-ol

C10H9NO — CID 87766208

IUPAC2H-2-benzazepin-4-ol
SMILESOC1=CNC=c2ccccc2=C1
InChIInChI=1S/C10H9NO/c12-10-5-8-3-1-2-4-9(8)6-11-7-10/h1-7,11-12H
InChIKeyFNGFGRABLYXOLW-UHFFFAOYSA-N
MW159.19 g/mol
LogP0.21
Rot. Bonds

About 2H-2-benzazepin-4-ol

2H-2-benzazepin-4-ol (PubChem CID 87766208) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 2H-2-benzazepin-4-ol.

Molecular Properties

Compound Name2H-2-benzazepin-4-ol
PubChem CID87766208
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name2H-2-benzazepin-4-ol
SMILESOC1=CNC=c2ccccc2=C1
InChIInChI=1S/C10H9NO/c12-10-5-8-3-1-2-4-9(8)6-11-7-10/h1-7,11-12H
InChIKeyFNGFGRABLYXOLW-UHFFFAOYSA-N
XLogP0.21
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2H-2-benzazepin-6-ol
CID 18004599
5-Hydroxycyclohepta[1,2-c]pyridine
CID 21276159
2H-isoquinoline-6,6-diol
CID 70388151
2H-cyclohepta[c]pyridin-1-ol
CID 88644641
2,5-dimethyl-1H-pyridin-2-ol
CID 89616467
(3Z,6E)-6-[(E)-2-aminoethenyl]octa-1,3,6-trien-2-ol
CID 138631285
2H-2-benzazepin-6-ol;hydrobromide
CID 141074641
1H-cyclohepta[b]pyridin-9-ol
CID 141340000
5-[2-(Methylamino)ethyl]cyclohepta-1,4,6-trien-1-ol
CID 142123446
2H-2-benzazepin-5-ol
CID 154081445
(4Z)-4-[(aminomethylamino)methylidene]cyclohexa-1,5-dien-1-ol
CID 163477952
4-(Aminomethylidene)cyclohexa-1,5-dien-1-ol
CID 163548670

Frequently Asked Questions

What is the IUPAC name of 2H-2-benzazepin-4-ol?
The IUPAC name of 2H-2-benzazepin-4-ol (CID 87766208) is 2H-2-benzazepin-4-ol.
What is the SMILES notation for 2H-2-benzazepin-4-ol?
The canonical SMILES for 2H-2-benzazepin-4-ol is OC1=CNC=c2ccccc2=C1.
What is the InChIKey of 2H-2-benzazepin-4-ol?
The InChIKey is FNGFGRABLYXOLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c12-10-5-8-3-1-2-4-9(8)6-11-7-10/h1-7,11-12H.
What are the key properties of 2H-2-benzazepin-4-ol?
2H-2-benzazepin-4-ol has a molecular weight of 159.19 g/mol, XLogP of 0.21, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-2-benzazepin-4-ol is sourced from PubChem (CID 87766208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).