5,6,6-trimethyl-5H-benzo[h]quinoline

C16H17N — CID 170777086

IUPAC5,6,6-trimethyl-5H-benzo[h]quinoline
SMILESCC1c2cccnc2-c2ccccc2C1(C)C
InChIInChI=1S/C16H17N/c1-11-12-8-6-10-17-15(12)13-7-4-5-9-14(13)16(11,2)3/h4-11H,1-3H3
InChIKeyLSEUCNASUFYERZ-UHFFFAOYSA-N
MW223.32 g/mol
LogP4.14
Rot. Bonds

About 5,6,6-trimethyl-5H-benzo[h]quinoline

5,6,6-trimethyl-5H-benzo[h]quinoline (PubChem CID 170777086) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is 5,6,6-trimethyl-5H-benzo[h]quinoline.

Molecular Properties

Compound Name5,6,6-trimethyl-5H-benzo[h]quinoline
PubChem CID170777086
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC Name5,6,6-trimethyl-5H-benzo[h]quinoline
SMILESCC1c2cccnc2-c2ccccc2C1(C)C
InChIInChI=1S/C16H17N/c1-11-12-8-6-10-17-15(12)13-7-4-5-9-14(13)16(11,2)3/h4-11H,1-3H3
InChIKeyLSEUCNASUFYERZ-UHFFFAOYSA-N
XLogP4.14
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5,6,6-trimethyl-5H-benzo[h]quinoline with MolForge

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Related Compounds

(1S)-1-methyl-6-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2(7),3,5,8,10,12(20),13,15,17-nonaene
CID 101391435
(2S)-2,3,3-trimethyl-2H-inden-1-one
CID 76958281
5,5-dichloroindeno[1,2-b]pyridine
CID 714437
4-(5,5-dimethylindeno[1,2-b]pyridin-2-yl)-8,8-dimethyl-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 59747241
6-azapentacyclo[12.4.2.01,14.02,7.08,13]icosa-2(7),3,5,8,10,12-hexaene
CID 140892102
3-azatricyclo[6.4.0.02,7]dodeca-1(12),2(7),3,5,8,10-hexaene;biphenylene
CID 175097557
5-(2-phenylphenyl)indeno[1,2-b]pyridin-5-ol
CID 59760565
1a,9b-dihydro-1H-azirino[2,3-f][1,7]phenanthroline
CID 10750358
benzene-1,2-diol;platinum;spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-fluorene]
CID 59661482
9,9-dimethylfluorene;ethane;quinoline
CID 159714824
beryllium bis(5,5-dimethylindeno[1,2-b]pyridin-9-olate)
CID 58049972
5,5,6-trimethyl-7,8-dihydro-6H-quinoline
CID 143150763

Frequently Asked Questions

What is the IUPAC name of 5,6,6-trimethyl-5H-benzo[h]quinoline?
The IUPAC name of 5,6,6-trimethyl-5H-benzo[h]quinoline (CID 170777086) is 5,6,6-trimethyl-5H-benzo[h]quinoline.
What is the SMILES notation for 5,6,6-trimethyl-5H-benzo[h]quinoline?
The canonical SMILES for 5,6,6-trimethyl-5H-benzo[h]quinoline is CC1c2cccnc2-c2ccccc2C1(C)C.
What is the InChIKey of 5,6,6-trimethyl-5H-benzo[h]quinoline?
The InChIKey is LSEUCNASUFYERZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N/c1-11-12-8-6-10-17-15(12)13-7-4-5-9-14(13)16(11,2)3/h4-11H,1-3H3.
What are the key properties of 5,6,6-trimethyl-5H-benzo[h]quinoline?
5,6,6-trimethyl-5H-benzo[h]quinoline has a molecular weight of 223.32 g/mol, XLogP of 4.14, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,6-trimethyl-5H-benzo[h]quinoline is sourced from PubChem (CID 170777086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).