2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol

C15H20N2O2 — CID 103046028

IUPAC2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol
SMILESCCNC(C)(CO)COc1cccc2ncccc12
InChIInChI=1S/C15H20N2O2/c1-3-17-15(2,10-18)11-19-14-8-4-7-13-12(14)6-5-9-16-13/h4-9,17-18H,3,10-11H2,1-2H3
InChIKeyFOIORAZTVWEARB-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.97
Rot. Bonds6

About 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol

2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol (PubChem CID 103046028) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol
PubChem CID103046028
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol
SMILESCCNC(C)(CO)COc1cccc2ncccc12
InChIInChI=1S/C15H20N2O2/c1-3-17-15(2,10-18)11-19-14-8-4-7-13-12(14)6-5-9-16-13/h4-9,17-18H,3,10-11H2,1-2H3
InChIKeyFOIORAZTVWEARB-UHFFFAOYSA-N
XLogP1.97
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol?
The IUPAC name of 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol (CID 103046028) is 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol.
What is the SMILES notation for 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol?
The canonical SMILES for 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol is CCNC(C)(CO)COc1cccc2ncccc12.
What is the InChIKey of 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol?
The InChIKey is FOIORAZTVWEARB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-17-15(2,10-18)11-19-14-8-4-7-13-12(14)6-5-9-16-13/h4-9,17-18H,3,10-11H2,1-2H3.
What are the key properties of 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol?
2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol has a molecular weight of 260.34 g/mol, XLogP of 1.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-3-quinolin-5-yloxypropan-1-ol is sourced from PubChem (CID 103046028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).