5H-benzo[d][1]benzazepine;1,2-oxazole

C17H14N2O — CID 159629628

IUPAC5H-benzo[d][1]benzazepine;1,2-oxazole
SMILESC1=Cc2ccccc2-c2ccccc2N1.c1cnoc1
InChIInChI=1S/C14H11N.C3H3NO/c1-2-6-12-11(5-1)9-10-15-14-8-4-3-7-13(12)14;1-2-4-5-3-1/h1-10,15H;1-3H
InChIKeyMOYJZUWOLDVFJS-UHFFFAOYSA-N
MW262.31 g/mol
LogP4.42
Rot. Bonds

About 5H-benzo[d][1]benzazepine;1,2-oxazole

5H-benzo[d][1]benzazepine;1,2-oxazole (PubChem CID 159629628) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is 5H-benzo[d][1]benzazepine;1,2-oxazole.

Molecular Properties

Compound Name5H-benzo[d][1]benzazepine;1,2-oxazole
PubChem CID159629628
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name5H-benzo[d][1]benzazepine;1,2-oxazole
SMILESC1=Cc2ccccc2-c2ccccc2N1.c1cnoc1
InChIInChI=1S/C14H11N.C3H3NO/c1-2-6-12-11(5-1)9-10-15-14-8-4-3-7-13(12)14;1-2-4-5-3-1/h1-10,15H;1-3H
InChIKeyMOYJZUWOLDVFJS-UHFFFAOYSA-N
XLogP4.42
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5H-benzo[d][1]benzazepine;1,2-oxazole?
The IUPAC name of 5H-benzo[d][1]benzazepine;1,2-oxazole (CID 159629628) is 5H-benzo[d][1]benzazepine;1,2-oxazole.
What is the SMILES notation for 5H-benzo[d][1]benzazepine;1,2-oxazole?
The canonical SMILES for 5H-benzo[d][1]benzazepine;1,2-oxazole is C1=Cc2ccccc2-c2ccccc2N1.c1cnoc1.
What is the InChIKey of 5H-benzo[d][1]benzazepine;1,2-oxazole?
The InChIKey is MOYJZUWOLDVFJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N.C3H3NO/c1-2-6-12-11(5-1)9-10-15-14-8-4-3-7-13(12)14;1-2-4-5-3-1/h1-10,15H;1-3H.
What are the key properties of 5H-benzo[d][1]benzazepine;1,2-oxazole?
5H-benzo[d][1]benzazepine;1,2-oxazole has a molecular weight of 262.31 g/mol, XLogP of 4.42, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-benzo[d][1]benzazepine;1,2-oxazole is sourced from PubChem (CID 159629628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).