3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol

C11H23NO2 — CID 57108485

IUPAC3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol
SMILESCCC(C)C1NCCOC1CCCO
InChIInChI=1S/C11H23NO2/c1-3-9(2)11-10(5-4-7-13)14-8-6-12-11/h9-13H,3-8H2,1-2H3
InChIKeyCZIOCKDTHSAKCC-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.16
Rot. Bonds5

About 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol

3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol (PubChem CID 57108485) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol
PubChem CID57108485
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol
SMILESCCC(C)C1NCCOC1CCCO
InChIInChI=1S/C11H23NO2/c1-3-9(2)11-10(5-4-7-13)14-8-6-12-11/h9-13H,3-8H2,1-2H3
InChIKeyCZIOCKDTHSAKCC-UHFFFAOYSA-N
XLogP1.16
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol?
The IUPAC name of 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol (CID 57108485) is 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol.
What is the SMILES notation for 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol?
The canonical SMILES for 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol is CCC(C)C1NCCOC1CCCO.
What is the InChIKey of 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol?
The InChIKey is CZIOCKDTHSAKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-3-9(2)11-10(5-4-7-13)14-8-6-12-11/h9-13H,3-8H2,1-2H3.
What are the key properties of 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol?
3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol has a molecular weight of 201.31 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-butan-2-ylmorpholin-2-yl)propan-1-ol is sourced from PubChem (CID 57108485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).