N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine

C16H24N2O — CID 82740081

IUPACN,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine
SMILESCC1OCCC1N(C)CC1CCNc2ccccc21
InChIInChI=1S/C16H24N2O/c1-12-16(8-10-19-12)18(2)11-13-7-9-17-15-6-4-3-5-14(13)15/h3-6,12-13,16-17H,7-11H2,1-2H3
InChIKeyIMDQEOBVZMCEMY-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.69
Rot. Bonds3

About N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine

N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine (PubChem CID 82740081) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine
PubChem CID82740081
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine
SMILESCC1OCCC1N(C)CC1CCNc2ccccc21
InChIInChI=1S/C16H24N2O/c1-12-16(8-10-19-12)18(2)11-13-7-9-17-15-6-4-3-5-14(13)15/h3-6,12-13,16-17H,7-11H2,1-2H3
InChIKeyIMDQEOBVZMCEMY-UHFFFAOYSA-N
XLogP2.69
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine?
The IUPAC name of N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine (CID 82740081) is N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine.
What is the SMILES notation for N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine?
The canonical SMILES for N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine is CC1OCCC1N(C)CC1CCNc2ccccc21.
What is the InChIKey of N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine?
The InChIKey is IMDQEOBVZMCEMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-16(8-10-19-12)18(2)11-13-7-9-17-15-6-4-3-5-14(13)15/h3-6,12-13,16-17H,7-11H2,1-2H3.
What are the key properties of N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine?
N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine has a molecular weight of 260.38 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(1,2,3,4-tetrahydroquinolin-4-ylmethyl)oxolan-3-amine is sourced from PubChem (CID 82740081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).