N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine

C17H23N3O — CID 63374484

IUPACN-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine
SMILESCCNCc1cc(N2CCOCC2C)c2ccccc2n1
InChIInChI=1S/C17H23N3O/c1-3-18-11-14-10-17(20-8-9-21-12-13(20)2)15-6-4-5-7-16(15)19-14/h4-7,10,13,18H,3,8-9,11-12H2,1-2H3
InChIKeyFTZFDTQLDUPVNV-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.57
Rot. Bonds4

About N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine

N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine (PubChem CID 63374484) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine
PubChem CID63374484
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine
SMILESCCNCc1cc(N2CCOCC2C)c2ccccc2n1
InChIInChI=1S/C17H23N3O/c1-3-18-11-14-10-17(20-8-9-21-12-13(20)2)15-6-4-5-7-16(15)19-14/h4-7,10,13,18H,3,8-9,11-12H2,1-2H3
InChIKeyFTZFDTQLDUPVNV-UHFFFAOYSA-N
XLogP2.57
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine?
The IUPAC name of N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine (CID 63374484) is N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine is CCNCc1cc(N2CCOCC2C)c2ccccc2n1.
What is the InChIKey of N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine?
The InChIKey is FTZFDTQLDUPVNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-3-18-11-14-10-17(20-8-9-21-12-13(20)2)15-6-4-5-7-16(15)19-14/h4-7,10,13,18H,3,8-9,11-12H2,1-2H3.
What are the key properties of N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine?
N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine has a molecular weight of 285.39 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(3-methylmorpholin-4-yl)quinolin-2-yl]methyl]ethanamine is sourced from PubChem (CID 63374484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).