2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine

C16H32N2O2 — CID 156547206

IUPAC2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine
SMILESCC(C)(CCC(C)(C)C1CNCCO1)C1COCCN1
InChIInChI=1S/C16H32N2O2/c1-15(2,13-12-19-9-8-18-13)5-6-16(3,4)14-11-17-7-10-20-14/h13-14,17-18H,5-12H2,1-4H3
InChIKeyQGZZSJJIRYZLBD-UHFFFAOYSA-N
MW284.44 g/mol
LogP1.80
Rot. Bonds5

About 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine

2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine (PubChem CID 156547206) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine.

Molecular Properties

Compound Name2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine
PubChem CID156547206
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine
SMILESCC(C)(CCC(C)(C)C1CNCCO1)C1COCCN1
InChIInChI=1S/C16H32N2O2/c1-15(2,13-12-19-9-8-18-13)5-6-16(3,4)14-11-17-7-10-20-14/h13-14,17-18H,5-12H2,1-4H3
InChIKeyQGZZSJJIRYZLBD-UHFFFAOYSA-N
XLogP1.80
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine?
The IUPAC name of 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine (CID 156547206) is 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine.
What is the SMILES notation for 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine?
The canonical SMILES for 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine is CC(C)(CCC(C)(C)C1CNCCO1)C1COCCN1.
What is the InChIKey of 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine?
The InChIKey is QGZZSJJIRYZLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-15(2,13-12-19-9-8-18-13)5-6-16(3,4)14-11-17-7-10-20-14/h13-14,17-18H,5-12H2,1-4H3.
What are the key properties of 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine?
2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine has a molecular weight of 284.44 g/mol, XLogP of 1.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethyl-5-morpholin-3-ylhexan-2-yl)morpholine is sourced from PubChem (CID 156547206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).