6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline

C14H21N — CID 126639373

IUPAC6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline
SMILESCC(C)(C)CC1CCc2ncccc2C1
InChIInChI=1S/C14H21N/c1-14(2,3)10-11-6-7-13-12(9-11)5-4-8-15-13/h4-5,8,11H,6-7,9-10H2,1-3H3
InChIKeyWQYHLWVYIGWZKU-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.62
Rot. Bonds1

About 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline

6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline (PubChem CID 126639373) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline
PubChem CID126639373
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline
SMILESCC(C)(C)CC1CCc2ncccc2C1
InChIInChI=1S/C14H21N/c1-14(2,3)10-11-6-7-13-12(9-11)5-4-8-15-13/h4-5,8,11H,6-7,9-10H2,1-3H3
InChIKeyWQYHLWVYIGWZKU-UHFFFAOYSA-N
XLogP3.62
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline (CID 126639373) is 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline is CC(C)(C)CC1CCc2ncccc2C1.
What is the InChIKey of 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline?
The InChIKey is WQYHLWVYIGWZKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-14(2,3)10-11-6-7-13-12(9-11)5-4-8-15-13/h4-5,8,11H,6-7,9-10H2,1-3H3.
What are the key properties of 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline?
6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline has a molecular weight of 203.33 g/mol, XLogP of 3.62, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 126639373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).