1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane

C16H26N4 — CID 91377926

IUPAC1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane
SMILESCC.CCc1nc2c(N)nc3c(c2n1CC)CCCC3
InChIInChI=1S/C14H20N4.C2H6/c1-3-11-17-12-13(18(11)4-2)9-7-5-6-8-10(9)16-14(12)15;1-2/h3-8H2,1-2H3,(H2,15,16);1-2H3
InChIKeyJUBMSZYECSDOQN-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.50
Rot. Bonds2

About 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane

1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane (PubChem CID 91377926) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane.

Molecular Properties

Compound Name1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane
PubChem CID91377926
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC Name1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane
SMILESCC.CCc1nc2c(N)nc3c(c2n1CC)CCCC3
InChIInChI=1S/C14H20N4.C2H6/c1-3-11-17-12-13(18(11)4-2)9-7-5-6-8-10(9)16-14(12)15;1-2/h3-8H2,1-2H3,(H2,15,16);1-2H3
InChIKeyJUBMSZYECSDOQN-UHFFFAOYSA-N
XLogP3.50
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane?
The IUPAC name of 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane (CID 91377926) is 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane.
What is the SMILES notation for 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane?
The canonical SMILES for 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane is CC.CCc1nc2c(N)nc3c(c2n1CC)CCCC3.
What is the InChIKey of 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane?
The InChIKey is JUBMSZYECSDOQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4.C2H6/c1-3-11-17-12-13(18(11)4-2)9-7-5-6-8-10(9)16-14(12)15;1-2/h3-8H2,1-2H3,(H2,15,16);1-2H3.
What are the key properties of 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane?
1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane has a molecular weight of 274.41 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diethyl-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-4-amine;ethane is sourced from PubChem (CID 91377926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).