N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine

C18H24N2O — CID 115797688

IUPACN-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine
SMILESCNC(c1cnc2ccccc2c1)C1C(C)OC(C)C1C
InChIInChI=1S/C18H24N2O/c1-11-12(2)21-13(3)17(11)18(19-4)15-9-14-7-5-6-8-16(14)20-10-15/h5-13,17-19H,1-4H3
InChIKeyAMPKNRCUPPBMCP-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.55
Rot. Bonds3

About N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine

N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine (PubChem CID 115797688) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine
PubChem CID115797688
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine
SMILESCNC(c1cnc2ccccc2c1)C1C(C)OC(C)C1C
InChIInChI=1S/C18H24N2O/c1-11-12(2)21-13(3)17(11)18(19-4)15-9-14-7-5-6-8-16(14)20-10-15/h5-13,17-19H,1-4H3
InChIKeyAMPKNRCUPPBMCP-UHFFFAOYSA-N
XLogP3.55
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine?
The IUPAC name of N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine (CID 115797688) is N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine?
The canonical SMILES for N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine is CNC(c1cnc2ccccc2c1)C1C(C)OC(C)C1C.
What is the InChIKey of N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine?
The InChIKey is AMPKNRCUPPBMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-11-12(2)21-13(3)17(11)18(19-4)15-9-14-7-5-6-8-16(14)20-10-15/h5-13,17-19H,1-4H3.
What are the key properties of N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine?
N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine has a molecular weight of 284.40 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-quinolin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)methanamine is sourced from PubChem (CID 115797688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).