[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol

C15H20N2O2 — CID 63375970

IUPAC[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol
SMILESCOCCCN(C)c1cc(CO)nc2ccccc12
InChIInChI=1S/C15H20N2O2/c1-17(8-5-9-19-2)15-10-12(11-18)16-14-7-4-3-6-13(14)15/h3-4,6-7,10,18H,5,8-9,11H2,1-2H3
InChIKeyWCEMSTSDLXPUAJ-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.20
Rot. Bonds6

About [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol

[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol (PubChem CID 63375970) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol.

Molecular Properties

Compound Name[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol
PubChem CID63375970
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol
SMILESCOCCCN(C)c1cc(CO)nc2ccccc12
InChIInChI=1S/C15H20N2O2/c1-17(8-5-9-19-2)15-10-12(11-18)16-14-7-4-3-6-13(14)15/h3-4,6-7,10,18H,5,8-9,11H2,1-2H3
InChIKeyWCEMSTSDLXPUAJ-UHFFFAOYSA-N
XLogP2.20
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol?
The IUPAC name of [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol (CID 63375970) is [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol.
What is the SMILES notation for [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol?
The canonical SMILES for [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol is COCCCN(C)c1cc(CO)nc2ccccc12.
What is the InChIKey of [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol?
The InChIKey is WCEMSTSDLXPUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-17(8-5-9-19-2)15-10-12(11-18)16-14-7-4-3-6-13(14)15/h3-4,6-7,10,18H,5,8-9,11H2,1-2H3.
What are the key properties of [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol?
[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol has a molecular weight of 260.34 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol is sourced from PubChem (CID 63375970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).