1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol

C15H20N2O2 — CID 75503246

IUPAC1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol
SMILESCOCC(O)CNc1c(C)c(C)nc2ccccc12
InChIInChI=1S/C15H20N2O2/c1-10-11(2)17-14-7-5-4-6-13(14)15(10)16-8-12(18)9-19-3/h4-7,12,18H,8-9H2,1-3H3,(H,16,17)
InChIKeyGYYGASNWBGGGJX-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.27
Rot. Bonds5

About 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol

1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol (PubChem CID 75503246) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol.

Molecular Properties

Compound Name1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol
PubChem CID75503246
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol
SMILESCOCC(O)CNc1c(C)c(C)nc2ccccc12
InChIInChI=1S/C15H20N2O2/c1-10-11(2)17-14-7-5-4-6-13(14)15(10)16-8-12(18)9-19-3/h4-7,12,18H,8-9H2,1-3H3,(H,16,17)
InChIKeyGYYGASNWBGGGJX-UHFFFAOYSA-N
XLogP2.27
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-hydroxy-3-methoxypropyl)amino]cinnoline-3-carboxylic acid
CID 64623751
1-[4-[(2,3-dimethylquinolin-4-yl)amino]piperidin-1-yl]-3-methoxypropan-2-ol
CID 133451891
ethane;N-ethyl-2,3-dimethylquinolin-4-amine
CID 142091780
1-methoxy-3-[(2-methylquinolin-4-yl)methylamino]propan-2-ol
CID 78993327
1-methoxy-4-[(3-methylquinoxalin-2-yl)amino]butan-2-ol
CID 103875708
1-methoxy-3-[methyl-(3-methylquinoxalin-2-yl)amino]propan-2-ol
CID 62375523
1-(2-chloroanilino)-3-methoxypropan-2-ol
CID 63929228
N-(3-methoxy-2-methylpropyl)-3-methylquinoxalin-2-amine
CID 47430216
1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol
CID 71996713
N-[(2,5-dimethyl-1,3-thiazol-4-yl)methyl]-2,3-dimethylquinolin-4-amine
CID 133451845
1-methoxy-3-[[(1R)-1-phenylethyl]amino]propan-2-ol
CID 78953875
1-[(6-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol
CID 133394039

Frequently Asked Questions

What is the IUPAC name of 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol?
The IUPAC name of 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol (CID 75503246) is 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol.
What is the SMILES notation for 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol?
The canonical SMILES for 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol is COCC(O)CNc1c(C)c(C)nc2ccccc12.
What is the InChIKey of 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol?
The InChIKey is GYYGASNWBGGGJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10-11(2)17-14-7-5-4-6-13(14)15(10)16-8-12(18)9-19-3/h4-7,12,18H,8-9H2,1-3H3,(H,16,17).
What are the key properties of 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol?
1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol has a molecular weight of 260.34 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,3-dimethylquinolin-4-yl)amino]-3-methoxypropan-2-ol is sourced from PubChem (CID 75503246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).