1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol

C13H20N2O — CID 66037691

IUPAC1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol
SMILESCNCC(C)(O)C1CCc2ccccc2N1
InChIInChI=1S/C13H20N2O/c1-13(16,9-14-2)12-8-7-10-5-3-4-6-11(10)15-12/h3-6,12,14-16H,7-9H2,1-2H3
InChIKeyZRTVJIINWKUYQD-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.38
Rot. Bonds3

About 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol

1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol (PubChem CID 66037691) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol.

Molecular Properties

Compound Name1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol
PubChem CID66037691
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol
SMILESCNCC(C)(O)C1CCc2ccccc2N1
InChIInChI=1S/C13H20N2O/c1-13(16,9-14-2)12-8-7-10-5-3-4-6-11(10)15-12/h3-6,12,14-16H,7-9H2,1-2H3
InChIKeyZRTVJIINWKUYQD-UHFFFAOYSA-N
XLogP1.38
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol?
The IUPAC name of 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol (CID 66037691) is 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol.
What is the SMILES notation for 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol?
The canonical SMILES for 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol is CNCC(C)(O)C1CCc2ccccc2N1.
What is the InChIKey of 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol?
The InChIKey is ZRTVJIINWKUYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-13(16,9-14-2)12-8-7-10-5-3-4-6-11(10)15-12/h3-6,12,14-16H,7-9H2,1-2H3.
What are the key properties of 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol?
1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol has a molecular weight of 220.32 g/mol, XLogP of 1.38, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol is sourced from PubChem (CID 66037691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).