2-(methylamino)-3-quinolin-8-yloxypropan-1-ol

C13H16N2O2 — CID 64803231

IUPAC2-(methylamino)-3-quinolin-8-yloxypropan-1-ol
SMILESCNC(CO)COc1cccc2cccnc12
InChIInChI=1S/C13H16N2O2/c1-14-11(8-16)9-17-12-6-2-4-10-5-3-7-15-13(10)12/h2-7,11,14,16H,8-9H2,1H3
InChIKeyUAQUHDVCUIHADM-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.19
Rot. Bonds5

About 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol

2-(methylamino)-3-quinolin-8-yloxypropan-1-ol (PubChem CID 64803231) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol.

Molecular Properties

Compound Name2-(methylamino)-3-quinolin-8-yloxypropan-1-ol
PubChem CID64803231
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name2-(methylamino)-3-quinolin-8-yloxypropan-1-ol
SMILESCNC(CO)COc1cccc2cccnc12
InChIInChI=1S/C13H16N2O2/c1-14-11(8-16)9-17-12-6-2-4-10-5-3-7-15-13(10)12/h2-7,11,14,16H,8-9H2,1H3
InChIKeyUAQUHDVCUIHADM-UHFFFAOYSA-N
XLogP1.19
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(ethylamino)-3-quinolin-8-yloxypropan-1-ol
CID 64805310
3-(ethylamino)-4-quinolin-8-yloxybutan-1-ol
CID 64899512
N-ethyl-1-quinolin-8-yloxybutan-2-amine
CID 62039773
3-N,3-N-dimethyl-4-quinolin-8-yloxybutane-1,3-diamine
CID 112501008
3-(methylamino)-4-quinolin-5-yloxybutan-1-ol
CID 103044503
8-(chloromethoxy)quinoline
CID 79531226
N-(2-quinolin-8-yloxyethyl)propan-2-amine
CID 29015226
2-ethoxy-3-quinolin-8-yloxypropan-1-amine
CID 63070438
3,3,3-trifluoro-2-(quinolin-8-yloxymethyl)propanethioamide
CID 103369087
8-[(2R)-1-methoxypropan-2-yl]oxyquinoline
CID 141434542
1-(N-phenylanilino)-3-quinolin-8-yloxypropan-2-ol
CID 3069813
methyl 2,2-dimethyl-3-quinolin-8-yloxypropanoate
CID 79622266

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol?
The IUPAC name of 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol (CID 64803231) is 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol.
What is the SMILES notation for 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol?
The canonical SMILES for 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol is CNC(CO)COc1cccc2cccnc12.
What is the InChIKey of 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol?
The InChIKey is UAQUHDVCUIHADM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-14-11(8-16)9-17-12-6-2-4-10-5-3-7-15-13(10)12/h2-7,11,14,16H,8-9H2,1H3.
What are the key properties of 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol?
2-(methylamino)-3-quinolin-8-yloxypropan-1-ol has a molecular weight of 232.28 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-3-quinolin-8-yloxypropan-1-ol is sourced from PubChem (CID 64803231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).