3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline

C18H26N2 — CID 90709937

IUPAC3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline
SMILESCCCC1(C)C2N(C)C=CN2c2ccccc2C1(C)C
InChIInChI=1S/C18H26N2/c1-6-11-18(4)16-19(5)12-13-20(16)15-10-8-7-9-14(15)17(18,2)3/h7-10,12-13,16H,6,11H2,1-5H3
InChIKeyWTMPWQHNQGCCIC-UHFFFAOYSA-N
MW270.42 g/mol
LogP4.33
Rot. Bonds2

About 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline

3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline (PubChem CID 90709937) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline.

Molecular Properties

Compound Name3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline
PubChem CID90709937
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline
SMILESCCCC1(C)C2N(C)C=CN2c2ccccc2C1(C)C
InChIInChI=1S/C18H26N2/c1-6-11-18(4)16-19(5)12-13-20(16)15-10-8-7-9-14(15)17(18,2)3/h7-10,12-13,16H,6,11H2,1-5H3
InChIKeyWTMPWQHNQGCCIC-UHFFFAOYSA-N
XLogP4.33
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline?
The IUPAC name of 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline (CID 90709937) is 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline.
What is the SMILES notation for 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline?
The canonical SMILES for 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline is CCCC1(C)C2N(C)C=CN2c2ccccc2C1(C)C.
What is the InChIKey of 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline?
The InChIKey is WTMPWQHNQGCCIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-6-11-18(4)16-19(5)12-13-20(16)15-10-8-7-9-14(15)17(18,2)3/h7-10,12-13,16H,6,11H2,1-5H3.
What are the key properties of 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline?
3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline has a molecular weight of 270.42 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,5-tetramethyl-4-propyl-3aH-imidazo[1,2-a]quinoline is sourced from PubChem (CID 90709937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).