(2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine

C11H21NO2 — CID 176863480

IUPAC(2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine
SMILESCC(C)OC[C@@H]1CNC[C@H](C2CC2)O1
InChIInChI=1S/C11H21NO2/c1-8(2)13-7-10-5-12-6-11(14-10)9-3-4-9/h8-12H,3-7H2,1-2H3/t10-,11+/m0/s1
InChIKeyDPWBYAMMUYGULH-WDEREUQCSA-N
MW199.29 g/mol
LogP1.18
Rot. Bonds4

About (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine

(2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine (PubChem CID 176863480) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine.

Molecular Properties

Compound Name(2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine
PubChem CID176863480
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name(2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine
SMILESCC(C)OC[C@@H]1CNC[C@H](C2CC2)O1
InChIInChI=1S/C11H21NO2/c1-8(2)13-7-10-5-12-6-11(14-10)9-3-4-9/h8-12H,3-7H2,1-2H3/t10-,11+/m0/s1
InChIKeyDPWBYAMMUYGULH-WDEREUQCSA-N
XLogP1.18
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine?
The IUPAC name of (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine (CID 176863480) is (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine.
What is the SMILES notation for (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine?
The canonical SMILES for (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine is CC(C)OC[C@@H]1CNC[C@H](C2CC2)O1.
What is the InChIKey of (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine?
The InChIKey is DPWBYAMMUYGULH-WDEREUQCSA-N. The full InChI is InChI=1S/C11H21NO2/c1-8(2)13-7-10-5-12-6-11(14-10)9-3-4-9/h8-12H,3-7H2,1-2H3/t10-,11+/m0/s1.
What are the key properties of (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine?
(2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine has a molecular weight of 199.29 g/mol, XLogP of 1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,6S)-2-cyclopropyl-6-(propan-2-yloxymethyl)morpholine is sourced from PubChem (CID 176863480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).