6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline

C14H21N — CID 82112626

IUPAC6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline
SMILESCCC1CCc2ncc(C(C)C)cc2C1
InChIInChI=1S/C14H21N/c1-4-11-5-6-14-12(7-11)8-13(9-15-14)10(2)3/h8-11H,4-7H2,1-3H3
InChIKeyCZZLKNSYIGFACU-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.72
Rot. Bonds2

About 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline

6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline (PubChem CID 82112626) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline
PubChem CID82112626
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline
SMILESCCC1CCc2ncc(C(C)C)cc2C1
InChIInChI=1S/C14H21N/c1-4-11-5-6-14-12(7-11)8-13(9-15-14)10(2)3/h8-11H,4-7H2,1-3H3
InChIKeyCZZLKNSYIGFACU-UHFFFAOYSA-N
XLogP3.72
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(+-)-Dimethindene
CID 21855
Quinoline
CID 7047
Pheniramine
CID 4761
6-Methylquinoline
CID 7059
5-Ethyl-2-methylpyridine
CID 7728
Anabaseine
CID 18985
4-Phenylpyridine
CID 13651
4-Methylquinoline
CID 10285
3-Pentylpyridine
CID 238307
2-(3-Phenylpropyl)Pyridine
CID 459494
8-Methylquinoline
CID 11910
3-Phenylpyridine
CID 13886

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline (CID 82112626) is 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline is CCC1CCc2ncc(C(C)C)cc2C1.
What is the InChIKey of 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline?
The InChIKey is CZZLKNSYIGFACU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-4-11-5-6-14-12(7-11)8-13(9-15-14)10(2)3/h8-11H,4-7H2,1-3H3.
What are the key properties of 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline?
6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline has a molecular weight of 203.33 g/mol, XLogP of 3.72, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3-propan-2-yl-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 82112626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).