1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine

C17H27N3O — CID 114399580

IUPAC1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
SMILESCCN1CCOC(CNCc2cccc3c2NCCC3)C1
InChIInChI=1S/C17H27N3O/c1-2-20-9-10-21-16(13-20)12-18-11-15-6-3-5-14-7-4-8-19-17(14)15/h3,5-6,16,18-19H,2,4,7-13H2,1H3
InChIKeyRSDFVQZNMVTOTE-UHFFFAOYSA-N
MW289.42 g/mol
LogP1.86
Rot. Bonds5

About 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine

1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine (PubChem CID 114399580) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
PubChem CID114399580
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
SMILESCCN1CCOC(CNCc2cccc3c2NCCC3)C1
InChIInChI=1S/C17H27N3O/c1-2-20-9-10-21-16(13-20)12-18-11-15-6-3-5-14-7-4-8-19-17(14)15/h3,5-6,16,18-19H,2,4,7-13H2,1H3
InChIKeyRSDFVQZNMVTOTE-UHFFFAOYSA-N
XLogP1.86
TPSA36.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-methylpyrrolidin-3-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
CID 80648401
2-[[(4-ethylmorpholin-2-yl)methylamino]methyl]benzamide
CID 114399817
1-(4-ethylmorpholin-2-yl)-N-(1H-pyrrol-2-ylmethyl)methanamine
CID 114399661
N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)butan-2-amine
CID 80648821
N-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)methyl]-1-(4-ethylmorpholin-2-yl)methanamine
CID 104702435
N-[(2,4-difluorophenyl)methyl]-1-(4-ethylmorpholin-2-yl)methanamine
CID 78946861
1-(4-ethylmorpholin-2-yl)-N-[(5-fluoro-2-methylphenyl)methyl]methanamine
CID 115968124
N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)propan-2-amine
CID 80648504
1-(4-ethylmorpholin-2-yl)-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]methanamine
CID 115756743
N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-(4-ethylmorpholin-2-yl)methanamine
CID 112705319
N-[(4-bromothiophen-3-yl)methyl]-1-(4-ethylmorpholin-2-yl)methanamine
CID 112739673
1-(4-ethylmorpholin-2-yl)-N-[(1-ethylpyrrol-3-yl)methyl]methanamine
CID 114399548

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine?
The IUPAC name of 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine (CID 114399580) is 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine.
What is the SMILES notation for 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine?
The canonical SMILES for 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine is CCN1CCOC(CNCc2cccc3c2NCCC3)C1.
What is the InChIKey of 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine?
The InChIKey is RSDFVQZNMVTOTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-2-20-9-10-21-16(13-20)12-18-11-15-6-3-5-14-7-4-8-19-17(14)15/h3,5-6,16,18-19H,2,4,7-13H2,1H3.
What are the key properties of 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine?
1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine has a molecular weight of 289.42 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylmorpholin-2-yl)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine is sourced from PubChem (CID 114399580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).