1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol

C16H19N3O — CID 19737315

IUPAC1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol
SMILESCCc1nc2cnc3ccccc3c2n1CC(C)(C)O
InChIInChI=1S/C16H19N3O/c1-4-14-18-13-9-17-12-8-6-5-7-11(12)15(13)19(14)10-16(2,3)20/h5-9,20H,4,10H2,1-3H3
InChIKeyXHADLYRNKJCOKP-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.92
Rot. Bonds3

About 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol

1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol (PubChem CID 19737315) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol
PubChem CID19737315
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol
SMILESCCc1nc2cnc3ccccc3c2n1CC(C)(C)O
InChIInChI=1S/C16H19N3O/c1-4-14-18-13-9-17-12-8-6-5-7-11(12)15(13)19(14)10-16(2,3)20/h5-9,20H,4,10H2,1-3H3
InChIKeyXHADLYRNKJCOKP-UHFFFAOYSA-N
XLogP2.92
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol?
The IUPAC name of 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol (CID 19737315) is 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol?
The canonical SMILES for 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol is CCc1nc2cnc3ccccc3c2n1CC(C)(C)O.
What is the InChIKey of 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol?
The InChIKey is XHADLYRNKJCOKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-4-14-18-13-9-17-12-8-6-5-7-11(12)15(13)19(14)10-16(2,3)20/h5-9,20H,4,10H2,1-3H3.
What are the key properties of 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol?
1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol has a molecular weight of 269.35 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol is sourced from PubChem (CID 19737315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).