(3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine

C16H30N2O2 — CID 131908541

IUPAC(3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine
SMILESC1CCCC(N[C@H]2COC[C@@H]2N2CCOCC2)CCC1
InChIInChI=1S/C16H30N2O2/c1-2-4-6-14(7-5-3-1)17-15-12-20-13-16(15)18-8-10-19-11-9-18/h14-17H,1-13H2/t15-,16-/m0/s1
InChIKeyADPXFGLBHCIMAA-HOTGVXAUSA-N
MW282.43 g/mol
LogP1.79
Rot. Bonds3

About (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine

(3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine (PubChem CID 131908541) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine.

Molecular Properties

Compound Name(3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine
PubChem CID131908541
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name(3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine
SMILESC1CCCC(N[C@H]2COC[C@@H]2N2CCOCC2)CCC1
InChIInChI=1S/C16H30N2O2/c1-2-4-6-14(7-5-3-1)17-15-12-20-13-16(15)18-8-10-19-11-9-18/h14-17H,1-13H2/t15-,16-/m0/s1
InChIKeyADPXFGLBHCIMAA-HOTGVXAUSA-N
XLogP1.79
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R,4S)-4-morpholin-4-yloxolan-3-ol
CID 11378780
N-cyclooctyl-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 43694307
N-cyclododecyloxan-4-amine
CID 43609748
N-methyl-2-(1,4-oxazepan-4-yl)cyclooctan-1-amine
CID 62988145
2-(1,4-oxazepan-4-yl)cyclododecan-1-ol
CID 62972583
4-[(3S,4R)-4-chlorooxolan-3-yl]morpholine
CID 11263993
N-cyclopentyloxan-4-amine
CID 28694035
N-cyclooctyloxepan-4-amine
CID 65076823
(3S,4S)-1-cycloheptyl-4-morpholin-4-ylpyrrolidin-3-ol
CID 131903256
N-cycloheptyloxan-3-amine
CID 63359772
4-(2-piperazin-1-ylcyclopentyl)morpholine
CID 121209586
5-methyl-N-[(3R,4R)-4-morpholin-4-yloxolan-3-yl]pyrazine-2-carboxamide
CID 91787977

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine?
The IUPAC name of (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine (CID 131908541) is (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine.
What is the SMILES notation for (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine?
The canonical SMILES for (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine is C1CCCC(N[C@H]2COC[C@@H]2N2CCOCC2)CCC1.
What is the InChIKey of (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine?
The InChIKey is ADPXFGLBHCIMAA-HOTGVXAUSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-2-4-6-14(7-5-3-1)17-15-12-20-13-16(15)18-8-10-19-11-9-18/h14-17H,1-13H2/t15-,16-/m0/s1.
What are the key properties of (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine?
(3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine has a molecular weight of 282.43 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-N-cyclooctyl-4-morpholin-4-yloxolan-3-amine is sourced from PubChem (CID 131908541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).