1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol

C15H20N2O2 — CID 71996713

IUPAC1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol
SMILESCOCC(O)CN(C)c1cc(C)c2ccccc2n1
InChIInChI=1S/C15H20N2O2/c1-11-8-15(17(2)9-12(18)10-19-3)16-14-7-5-4-6-13(11)14/h4-8,12,18H,9-10H2,1-3H3
InChIKeyITDVUZPYZJUOPH-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.99
Rot. Bonds5

About 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol

1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol (PubChem CID 71996713) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol
PubChem CID71996713
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol
SMILESCOCC(O)CN(C)c1cc(C)c2ccccc2n1
InChIInChI=1S/C15H20N2O2/c1-11-8-15(17(2)9-12(18)10-19-3)16-14-7-5-4-6-13(11)14/h4-8,12,18H,9-10H2,1-3H3
InChIKeyITDVUZPYZJUOPH-UHFFFAOYSA-N
XLogP1.99
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methoxy-3-[methyl-(3-methylquinoxalin-2-yl)amino]propan-2-ol
CID 62375523
1-methoxy-3-[methyl-(4-phenylquinazolin-2-yl)amino]propan-2-ol
CID 47069006
1-[1,3-benzoxazol-2-yl(methyl)amino]-3-methoxypropan-2-ol
CID 54979252
1-methoxy-3-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80811552
1-[1H-benzimidazol-2-yl(methyl)amino]-3-methoxypropan-2-ol
CID 55125582
[2-[2-methoxyethyl(methyl)amino]quinolin-4-yl]methanol
CID 61427550
1-[(5-bromo-6-methyl-2-pyridinyl)-methylamino]-3-methoxypropan-2-ol
CID 75443197
2-chloro-6-[(2-hydroxy-3-methoxypropyl)-methylamino]pyridine-4-carboxylic acid
CID 54998875
1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol
CID 75404929
1-[[2-(dimethylamino)pyrimidin-4-yl]-methylamino]-3-methoxypropan-2-ol
CID 64828925
1-methoxy-3-[methyl(pyrido[2,3-b]pyrazin-6-yl)amino]propan-2-ol
CID 78955195
1-[(2-aminopyrimidin-4-yl)-methylamino]-3-methoxypropan-2-ol
CID 80811340

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol?
The IUPAC name of 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol (CID 71996713) is 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol.
What is the SMILES notation for 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol?
The canonical SMILES for 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol is COCC(O)CN(C)c1cc(C)c2ccccc2n1.
What is the InChIKey of 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol?
The InChIKey is ITDVUZPYZJUOPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-11-8-15(17(2)9-12(18)10-19-3)16-14-7-5-4-6-13(11)14/h4-8,12,18H,9-10H2,1-3H3.
What are the key properties of 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol?
1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol has a molecular weight of 260.34 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[methyl-(4-methylquinolin-2-yl)amino]propan-2-ol is sourced from PubChem (CID 71996713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).