2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine

C16H24N2O — CID 66426870

IUPAC2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine
SMILESc1ccc2c(c1)CCCCN2CCC1CNCCO1
InChIInChI=1S/C16H24N2O/c1-2-7-16-14(5-1)6-3-4-10-18(16)11-8-15-13-17-9-12-19-15/h1-2,5,7,15,17H,3-4,6,8-13H2
InChIKeyAZGHBMYPPRXCCJ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.21
Rot. Bonds3

About 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine

2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine (PubChem CID 66426870) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine
PubChem CID66426870
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine
SMILESc1ccc2c(c1)CCCCN2CCC1CNCCO1
InChIInChI=1S/C16H24N2O/c1-2-7-16-14(5-1)6-3-4-10-18(16)11-8-15-13-17-9-12-19-15/h1-2,5,7,15,17H,3-4,6,8-13H2
InChIKeyAZGHBMYPPRXCCJ-UHFFFAOYSA-N
XLogP2.21
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 ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[(3S)-piperidin-3-yl]ethyl]-3,4-dihydro-2H-quinoline
CID 86323488
1-[2-(1,3-dioxan-2-yl)ethyl]-3,4-dihydro-2H-quinoline
CID 66472298
1-(2-piperidin-3-ylethyl)-2,3-dihydroindole;dihydrochloride
CID 53408240
2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethanol
CID 15488047
2-[2-(7-bromo-3,4-dihydro-2H-quinoxalin-1-yl)ethyl]morpholine
CID 117030541
1-(2-cyclohexylethyl)-3,4-dihydro-2H-quinoline
CID 154337689
2-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]morpholine
CID 63778262
1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,2,3,4-tetrahydroisoquinoline
CID 112507559
2-ethylmorpholine;1-methylpyrrolidine
CID 67235246
1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-quinoline
CID 59807075
2-[(5-ethyl-2,3-dihydroindol-1-yl)methyl]morpholine
CID 154784835
1-(4-piperazin-1-ylbutyl)-3,4-dihydro-2H-quinoline
CID 28808284

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine?
The IUPAC name of 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine (CID 66426870) is 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine.
What is the SMILES notation for 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine?
The canonical SMILES for 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine is c1ccc2c(c1)CCCCN2CCC1CNCCO1.
What is the InChIKey of 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine?
The InChIKey is AZGHBMYPPRXCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-7-16-14(5-1)6-3-4-10-18(16)11-8-15-13-17-9-12-19-15/h1-2,5,7,15,17H,3-4,6,8-13H2.
What are the key properties of 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine?
2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine has a molecular weight of 260.38 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]morpholine is sourced from PubChem (CID 66426870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).