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

C14H21N — CID 138515872

IUPAC7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline
SMILESCC(C)(C)CC1CCc2cccnc2C1
InChIInChI=1S/C14H21N/c1-14(2,3)10-11-6-7-12-5-4-8-15-13(12)9-11/h4-5,8,11H,6-7,9-10H2,1-3H3
InChIKeyGVKIVHUHCUQOQZ-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.62
Rot. Bonds1

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

7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline (PubChem CID 138515872) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline
PubChem CID138515872
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline
SMILESCC(C)(C)CC1CCc2cccnc2C1
InChIInChI=1S/C14H21N/c1-14(2,3)10-11-6-7-12-5-4-8-15-13(12)9-11/h4-5,8,11H,6-7,9-10H2,1-3H3
InChIKeyGVKIVHUHCUQOQZ-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

Analyze 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline
CID 126639373
(7S)-7-tert-butyl-5,6,7,8-tetrahydroquinoline
CID 69281697
ethane;(7S)-7-methyl-5,6,7,8-tetrahydroquinoline
CID 143143665
5,6,7,8-tetrahydroquinolin-7-amine;hydrochloride
CID 156621052
6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-7-ylmethanamine
CID 123242170
6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane
CID 145086188
(Z)-2-N-iodo-1-(5,6,7,8-tetrahydroquinolin-7-yl)but-2-ene-2,3-diamine
CID 89261198
(7R)-7-[3-(1H-pyrazol-5-yl)propyl]-5,6,7,8-tetrahydroquinoline
CID 159103628
5,6,7,8-tetrahydroquinolin-6-ylmethanol
CID 69108967
(5,6,7,8-tetrahydroquinolin-7-ylamino)methanol
CID 14835920
7-(azetidin-1-yl)-5,6,7,8-tetrahydroquinoline
CID 14835988
ethane;6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 90875415

Frequently Asked Questions

What is the IUPAC name of 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline (CID 138515872) is 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline is CC(C)(C)CC1CCc2cccnc2C1.
What is the InChIKey of 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline?
The InChIKey is GVKIVHUHCUQOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-14(2,3)10-11-6-7-12-5-4-8-15-13(12)9-11/h4-5,8,11H,6-7,9-10H2,1-3H3.
What are the key properties of 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline?
7-(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 7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 138515872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).