3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol

C16H33NO2 — CID 79657527

IUPAC3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol
SMILESCCCCC(CC)CC(O)C1CN(CCC)CCO1
InChIInChI=1S/C16H33NO2/c1-4-7-8-14(6-3)12-15(18)16-13-17(9-5-2)10-11-19-16/h14-16,18H,4-13H2,1-3H3
InChIKeyAQHNHZNFWOZLJE-UHFFFAOYSA-N
MW271.44 g/mol
LogP3.06
Rot. Bonds9

About 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol

3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol (PubChem CID 79657527) has the molecular formula C16H33NO2 and a molecular weight of 271.44 g/mol. Its IUPAC name is 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol.

Molecular Properties

Compound Name3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol
PubChem CID79657527
Molecular FormulaC16H33NO2
Molecular Weight271.44 g/mol
Exact Mass271.25
IUPAC Name3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol
SMILESCCCCC(CC)CC(O)C1CN(CCC)CCO1
InChIInChI=1S/C16H33NO2/c1-4-7-8-14(6-3)12-15(18)16-13-17(9-5-2)10-11-19-16/h14-16,18H,4-13H2,1-3H3
InChIKeyAQHNHZNFWOZLJE-UHFFFAOYSA-N
XLogP3.06
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.44
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-propylmorpholin-2-yl)pentan-1-ol
CID 79668705
1-(4-propylmorpholin-2-yl)hexan-1-ol
CID 79669554
1-(4-propylmorpholin-2-yl)undecan-1-ol
CID 79663521
3-ethyl-1-(1,4-oxathian-2-yl)heptan-1-ol
CID 79963099
4-methylsulfonyl-1-(4-propylmorpholin-2-yl)butan-1-ol
CID 79669633
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
3-methyl-1-(4-methylmorpholin-2-yl)pentan-1-ol
CID 79087186
2-(5-bromo-3-pyridinyl)-1-(4-propylmorpholin-2-yl)ethanol
CID 104800383
2-(4-fluoro-2-methylphenyl)-1-(4-propylmorpholin-2-yl)ethanol
CID 114347522
2-(2-ethyl-1,2,4-triazol-3-yl)-1-(4-propylmorpholin-2-yl)ethanol
CID 79669792

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol?
The IUPAC name of 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol (CID 79657527) is 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol.
What is the SMILES notation for 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol?
The canonical SMILES for 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol is CCCCC(CC)CC(O)C1CN(CCC)CCO1.
What is the InChIKey of 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol?
The InChIKey is AQHNHZNFWOZLJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO2/c1-4-7-8-14(6-3)12-15(18)16-13-17(9-5-2)10-11-19-16/h14-16,18H,4-13H2,1-3H3.
What are the key properties of 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol?
3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol has a molecular weight of 271.44 g/mol, XLogP of 3.06, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(4-propylmorpholin-2-yl)heptan-1-ol is sourced from PubChem (CID 79657527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).