2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline

C15H23N — CID 117193884

IUPAC2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline
SMILESCCC1(C)Nc2cc(C)ccc2C(C)C1C
InChIInChI=1S/C15H23N/c1-6-15(5)12(4)11(3)13-8-7-10(2)9-14(13)16-15/h7-9,11-12,16H,6H2,1-5H3
InChIKeyZKYDHGMFBNPWCR-UHFFFAOYSA-N
MW217.36 g/mol
LogP4.33
Rot. Bonds1

About 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline

2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline (PubChem CID 117193884) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline.

Molecular Properties

Compound Name2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline
PubChem CID117193884
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline
SMILESCCC1(C)Nc2cc(C)ccc2C(C)C1C
InChIInChI=1S/C15H23N/c1-6-15(5)12(4)11(3)13-8-7-10(2)9-14(13)16-15/h7-9,11-12,16H,6H2,1-5H3
InChIKeyZKYDHGMFBNPWCR-UHFFFAOYSA-N
XLogP4.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline?
The IUPAC name of 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline (CID 117193884) is 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline.
What is the SMILES notation for 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline?
The canonical SMILES for 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline is CCC1(C)Nc2cc(C)ccc2C(C)C1C.
What is the InChIKey of 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline?
The InChIKey is ZKYDHGMFBNPWCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-6-15(5)12(4)11(3)13-8-7-10(2)9-14(13)16-15/h7-9,11-12,16H,6H2,1-5H3.
What are the key properties of 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline?
2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline has a molecular weight of 217.36 g/mol, XLogP of 4.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2,3,4,7-tetramethyl-3,4-dihydro-1H-quinoline is sourced from PubChem (CID 117193884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).