indolo[2,1-b][1,3]benzoxazin-12-one

C15H9NO2 — CID 56963988

IUPACindolo[2,1-b][1,3]benzoxazin-12-one
SMILESO=c1c2ccccc2oc2cc3ccccc3n12
InChIInChI=1S/C15H9NO2/c17-15-11-6-2-4-8-13(11)18-14-9-10-5-1-3-7-12(10)16(14)15/h1-9H
InChIKeyCEKNGABJFDPACH-UHFFFAOYSA-N
MW235.24 g/mol
LogP3.20
Rot. Bonds

About indolo[2,1-b][1,3]benzoxazin-12-one

indolo[2,1-b][1,3]benzoxazin-12-one (PubChem CID 56963988) has the molecular formula C15H9NO2 and a molecular weight of 235.24 g/mol. Its IUPAC name is indolo[2,1-b][1,3]benzoxazin-12-one.

Molecular Properties

Compound Nameindolo[2,1-b][1,3]benzoxazin-12-one
PubChem CID56963988
Molecular FormulaC15H9NO2
Molecular Weight235.24 g/mol
Exact Mass235.06
IUPAC Nameindolo[2,1-b][1,3]benzoxazin-12-one
SMILESO=c1c2ccccc2oc2cc3ccccc3n12
InChIInChI=1S/C15H9NO2/c17-15-11-6-2-4-8-13(11)18-14-9-10-5-1-3-7-12(10)16(14)15/h1-9H
InChIKeyCEKNGABJFDPACH-UHFFFAOYSA-N
XLogP3.20
TPSA34.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

8-dibenzofuran-2-yl-[1,3]benzoxazolo[3,2-b]isoquinolin-11-one
CID 163394929
20-oxa-2-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),3,5,7,9,11,14,16,18-nonaen-21-one
CID 132552377
12-oxa-10-azapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2,4,6,8,14,16,18,20-nonaen-11-one
CID 177426300
10-oxa-22-thia-2,12-diazahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),4,6,8,11,14,16,18,20,23-decaen-3-one
CID 156870731
11-oxa-15-azanonacyclo[22.12.0.02,14.04,12.05,10.015,23.016,21.025,30.031,36]hexatriaconta-1(24),2(14),3,5,7,9,12,16,18,20,22,25,27,29,31,33,35-heptadecaene
CID 139436379
3-dibenzofuran-2-ylbenzimidazolo[2,1-b][1,3]benzothiazin-12-one
CID 162723051
10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one
CID 13000725
6-phenylisoquinolino[2,1-b]isoquinolin-8-one
CID 164679594
26-oxa-1-azaoctacyclo[14.13.1.02,11.04,9.012,30.017,29.019,27.020,25]triaconta-2,4,6,8,10,12(30),13,15,17(29),18,20,22,24,27-tetradecaene
CID 146376243
11-dibenzofuran-2-yl-5,17-diphenyl-1-azapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,9,11,13(21),14(19),15,17-nonaene-2,20-dione
CID 118390329
11-dibenzofuran-2-yl-6,16-diphenyl-1-azapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,9,11,13(21),14(19),15,17-nonaene-2,20-dione
CID 118390318
16-oxa-9-thia-14,24-diazahexacyclo[11.11.0.02,10.03,8.015,24.017,22]tetracosa-1(13),2(10),3,5,7,11,14,17,19,21-decaen-23-one
CID 156870596

Frequently Asked Questions

What is the IUPAC name of indolo[2,1-b][1,3]benzoxazin-12-one?
The IUPAC name of indolo[2,1-b][1,3]benzoxazin-12-one (CID 56963988) is indolo[2,1-b][1,3]benzoxazin-12-one.
What is the SMILES notation for indolo[2,1-b][1,3]benzoxazin-12-one?
The canonical SMILES for indolo[2,1-b][1,3]benzoxazin-12-one is O=c1c2ccccc2oc2cc3ccccc3n12.
What is the InChIKey of indolo[2,1-b][1,3]benzoxazin-12-one?
The InChIKey is CEKNGABJFDPACH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9NO2/c17-15-11-6-2-4-8-13(11)18-14-9-10-5-1-3-7-12(10)16(14)15/h1-9H.
What are the key properties of indolo[2,1-b][1,3]benzoxazin-12-one?
indolo[2,1-b][1,3]benzoxazin-12-one has a molecular weight of 235.24 g/mol, XLogP of 3.20, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for indolo[2,1-b][1,3]benzoxazin-12-one is sourced from PubChem (CID 56963988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).