1-(4-propylmorpholin-2-yl)hexan-1-ol

C13H27NO2 — CID 79669554

IUPAC1-(4-propylmorpholin-2-yl)hexan-1-ol
SMILESCCCCCC(O)C1CN(CCC)CCO1
InChIInChI=1S/C13H27NO2/c1-3-5-6-7-12(15)13-11-14(8-4-2)9-10-16-13/h12-13,15H,3-11H2,1-2H3
InChIKeyRXGVEHFEAGMDNE-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.04
Rot. Bonds7

About 1-(4-propylmorpholin-2-yl)hexan-1-ol

1-(4-propylmorpholin-2-yl)hexan-1-ol (PubChem CID 79669554) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 1-(4-propylmorpholin-2-yl)hexan-1-ol.

Molecular Properties

Compound Name1-(4-propylmorpholin-2-yl)hexan-1-ol
PubChem CID79669554
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name1-(4-propylmorpholin-2-yl)hexan-1-ol
SMILESCCCCCC(O)C1CN(CCC)CCO1
InChIInChI=1S/C13H27NO2/c1-3-5-6-7-12(15)13-11-14(8-4-2)9-10-16-13/h12-13,15H,3-11H2,1-2H3
InChIKeyRXGVEHFEAGMDNE-UHFFFAOYSA-N
XLogP2.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(4-propylmorpholin-2-yl)undecan-1-ol
CID 79663521
1-(4-propylmorpholin-2-yl)pentan-1-ol
CID 79668705
4-methylsulfonyl-1-(4-propylmorpholin-2-yl)butan-1-ol
CID 79669633
3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol
CID 79657527
2-propan-2-yl-4-propylmorpholine
CID 58468712
(1S)-1-[(2R)-4-ethylmorpholin-2-yl]ethane-1,2-diol
CID 177187353
1-(4-propylmorpholin-2-yl)ethanamine
CID 79658084
(1S)-1-[(2R)-oxolan-2-yl]hexan-1-ol
CID 10997513
(1R)-1-[(2R)-oxolan-2-yl]tridecan-1-ol
CID 11086843
1-(oxolan-2-yl)heptan-1-ol
CID 65331076
1-(oxiran-2-yl)dodecan-1-ol
CID 14843341
1-(oxiran-2-yl)octadecan-1-ol
CID 57011592

Frequently Asked Questions

What is the IUPAC name of 1-(4-propylmorpholin-2-yl)hexan-1-ol?
The IUPAC name of 1-(4-propylmorpholin-2-yl)hexan-1-ol (CID 79669554) is 1-(4-propylmorpholin-2-yl)hexan-1-ol.
What is the SMILES notation for 1-(4-propylmorpholin-2-yl)hexan-1-ol?
The canonical SMILES for 1-(4-propylmorpholin-2-yl)hexan-1-ol is CCCCCC(O)C1CN(CCC)CCO1.
What is the InChIKey of 1-(4-propylmorpholin-2-yl)hexan-1-ol?
The InChIKey is RXGVEHFEAGMDNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-3-5-6-7-12(15)13-11-14(8-4-2)9-10-16-13/h12-13,15H,3-11H2,1-2H3.
What are the key properties of 1-(4-propylmorpholin-2-yl)hexan-1-ol?
1-(4-propylmorpholin-2-yl)hexan-1-ol has a molecular weight of 229.36 g/mol, XLogP of 2.04, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propylmorpholin-2-yl)hexan-1-ol is sourced from PubChem (CID 79669554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).