2-(1,2-diethoxyhexan-2-yl)morpholine

C14H29NO3 — CID 68590307

IUPAC2-(1,2-diethoxyhexan-2-yl)morpholine
SMILESCCCCC(COCC)(OCC)C1CNCCO1
InChIInChI=1S/C14H29NO3/c1-4-7-8-14(18-6-3,12-16-5-2)13-11-15-9-10-17-13/h13,15H,4-12H2,1-3H3
InChIKeyNIIOVUODAYSPPC-UHFFFAOYSA-N
MW259.39 g/mol
LogP1.98
Rot. Bonds9

About 2-(1,2-diethoxyhexan-2-yl)morpholine

2-(1,2-diethoxyhexan-2-yl)morpholine (PubChem CID 68590307) has the molecular formula C14H29NO3 and a molecular weight of 259.39 g/mol. Its IUPAC name is 2-(1,2-diethoxyhexan-2-yl)morpholine.

Molecular Properties

Compound Name2-(1,2-diethoxyhexan-2-yl)morpholine
PubChem CID68590307
Molecular FormulaC14H29NO3
Molecular Weight259.39 g/mol
Exact Mass259.21
IUPAC Name2-(1,2-diethoxyhexan-2-yl)morpholine
SMILESCCCCC(COCC)(OCC)C1CNCCO1
InChIInChI=1S/C14H29NO3/c1-4-7-8-14(18-6-3,12-16-5-2)13-11-15-9-10-17-13/h13,15H,4-12H2,1-3H3
InChIKeyNIIOVUODAYSPPC-UHFFFAOYSA-N
XLogP1.98
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,2-diethoxyhexan-2-yl)morpholine?
The IUPAC name of 2-(1,2-diethoxyhexan-2-yl)morpholine (CID 68590307) is 2-(1,2-diethoxyhexan-2-yl)morpholine.
What is the SMILES notation for 2-(1,2-diethoxyhexan-2-yl)morpholine?
The canonical SMILES for 2-(1,2-diethoxyhexan-2-yl)morpholine is CCCCC(COCC)(OCC)C1CNCCO1.
What is the InChIKey of 2-(1,2-diethoxyhexan-2-yl)morpholine?
The InChIKey is NIIOVUODAYSPPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO3/c1-4-7-8-14(18-6-3,12-16-5-2)13-11-15-9-10-17-13/h13,15H,4-12H2,1-3H3.
What are the key properties of 2-(1,2-diethoxyhexan-2-yl)morpholine?
2-(1,2-diethoxyhexan-2-yl)morpholine has a molecular weight of 259.39 g/mol, XLogP of 1.98, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-diethoxyhexan-2-yl)morpholine is sourced from PubChem (CID 68590307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).