11H-indeno[1,2-h]isoquinoline-1-sulfonamide

C16H12N2O2S — CID 86706711

IUPAC11H-indeno[1,2-h]isoquinoline-1-sulfonamide
SMILESNS(=O)(=O)c1nccc2ccc3c(c12)Cc1ccccc1-3
InChIInChI=1S/C16H12N2O2S/c17-21(19,20)16-15-10(7-8-18-16)5-6-13-12-4-2-1-3-11(12)9-14(13)15/h1-8H,9H2,(H2,17,19,20)
InChIKeyQAYQNRCNNPGDON-UHFFFAOYSA-N
MW296.35 g/mol
LogP2.45
Rot. Bonds1

About 11H-indeno[1,2-h]isoquinoline-1-sulfonamide

11H-indeno[1,2-h]isoquinoline-1-sulfonamide (PubChem CID 86706711) has the molecular formula C16H12N2O2S and a molecular weight of 296.35 g/mol. Its IUPAC name is 11H-indeno[1,2-h]isoquinoline-1-sulfonamide.

Molecular Properties

Compound Name11H-indeno[1,2-h]isoquinoline-1-sulfonamide
PubChem CID86706711
Molecular FormulaC16H12N2O2S
Molecular Weight296.35 g/mol
Exact Mass296.06
IUPAC Name11H-indeno[1,2-h]isoquinoline-1-sulfonamide
SMILESNS(=O)(=O)c1nccc2ccc3c(c12)Cc1ccccc1-3
InChIInChI=1S/C16H12N2O2S/c17-21(19,20)16-15-10(7-8-18-16)5-6-13-12-4-2-1-3-11(12)9-14(13)15/h1-8H,9H2,(H2,17,19,20)
InChIKeyQAYQNRCNNPGDON-UHFFFAOYSA-N
XLogP2.45
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.35
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

19,20-diazapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaene
CID 154254757
1-naphthalen-1-yl-11H-benzo[a]fluorene
CID 157136460
decacyclo[18.18.0.02,17.04,16.05,13.07,12.021,37.024,36.025,34.028,33]octatriaconta-1(20),2(17),4(16),5(13),7,9,11,14,18,21(37),22,24(36),25(34),26,28,30,32-heptadecaene
CID 160943205
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
1-nitro-9H-indeno[2,1-c]pyridine
CID 154332793
6-methyl-5-propan-2-ylhexacyclo[11.11.0.02,10.04,9.016,24.017,22]tetracosa-1(13),2(10),4(9),5,7,11,14,16(24),17,19,21-undecaene
CID 158481234
3-phenylpyridine-2-sulfonamide
CID 22113912
4-chloro-11H-indeno[1,2-h]quinoline
CID 70373092
9H-fluorene-1,2-disulfonic acid
CID 22770255
8-(9H-fluoren-1-yl)quinoline
CID 151254514
19-[3-(3,5-diphenylphenyl)phenyl]pentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaene
CID 123937708
19,19-diphenyl-20-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17-nonaene
CID 170219409

Frequently Asked Questions

What is the IUPAC name of 11H-indeno[1,2-h]isoquinoline-1-sulfonamide?
The IUPAC name of 11H-indeno[1,2-h]isoquinoline-1-sulfonamide (CID 86706711) is 11H-indeno[1,2-h]isoquinoline-1-sulfonamide.
What is the SMILES notation for 11H-indeno[1,2-h]isoquinoline-1-sulfonamide?
The canonical SMILES for 11H-indeno[1,2-h]isoquinoline-1-sulfonamide is NS(=O)(=O)c1nccc2ccc3c(c12)Cc1ccccc1-3.
What is the InChIKey of 11H-indeno[1,2-h]isoquinoline-1-sulfonamide?
The InChIKey is QAYQNRCNNPGDON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2S/c17-21(19,20)16-15-10(7-8-18-16)5-6-13-12-4-2-1-3-11(12)9-14(13)15/h1-8H,9H2,(H2,17,19,20).
What are the key properties of 11H-indeno[1,2-h]isoquinoline-1-sulfonamide?
11H-indeno[1,2-h]isoquinoline-1-sulfonamide has a molecular weight of 296.35 g/mol, XLogP of 2.45, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11H-indeno[1,2-h]isoquinoline-1-sulfonamide is sourced from PubChem (CID 86706711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).