1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one

C91H177N5O10 — CID 157306330

IUPAC1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one
SMILESCCCCCCCCC(=O)N1CCOCC1.CCCCCCCCCCC(=O)N1CC(C)OC(C)C1.CCCCCCCCCCCCC(=O)N1CC(C)OC(C)C1.CCCCCCCCCCCCCC(=O)N1CC(C)OC(C)C1.CCCCCCCCCCCCCCCCCC(=O)N1CCOCC1
InChIInChI=1S/C22H43NO2.C20H39NO2.C19H37NO2.C17H33NO2.C13H25NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(24)23-18-20-25-21-19-23;1-4-5-6-7-8-9-10-11-12-13-14-15-20(22)21-16-18(2)23-19(3)17-21;1-4-5-6-7-8-9-10-11-12-13-14-19(21)20-15-17(2)22-18(3)16-20;1-4-5-6-7-8-9-10-11-12-17(19)18-13-15(2)20-16(3)14-18;1-2-3-4-5-6-7-8-13(15)14-9-11-16-12-10-14/h2-21H2,1H3;18-19H,4-17H2,1-3H3;17-18H,4-16H2,1-3H3;15-16H,4-14H2,1-3H3;2-12H2,1H3
InChIKeyBCNCHIMWQWWVOB-UHFFFAOYSA-N
MW1501.44 g/mol
LogP23.11
Rot. Bonds55

About 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one

1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one (PubChem CID 157306330) has the molecular formula C91H177N5O10 and a molecular weight of 1501.44 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one
PubChem CID157306330
Molecular FormulaC91H177N5O10
Molecular Weight1501.44 g/mol
Exact Mass1500.35
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one
SMILESCCCCCCCCC(=O)N1CCOCC1.CCCCCCCCCCC(=O)N1CC(C)OC(C)C1.CCCCCCCCCCCCC(=O)N1CC(C)OC(C)C1.CCCCCCCCCCCCCC(=O)N1CC(C)OC(C)C1.CCCCCCCCCCCCCCCCCC(=O)N1CCOCC1
InChIInChI=1S/C22H43NO2.C20H39NO2.C19H37NO2.C17H33NO2.C13H25NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(24)23-18-20-25-21-19-23;1-4-5-6-7-8-9-10-11-12-13-14-15-20(22)21-16-18(2)23-19(3)17-21;1-4-5-6-7-8-9-10-11-12-13-14-19(21)20-15-17(2)22-18(3)16-20;1-4-5-6-7-8-9-10-11-12-17(19)18-13-15(2)20-16(3)14-18;1-2-3-4-5-6-7-8-13(15)14-9-11-16-12-10-14/h2-21H2,1H3;18-19H,4-17H2,1-3H3;17-18H,4-16H2,1-3H3;15-16H,4-14H2,1-3H3;2-12H2,1H3
InChIKeyBCNCHIMWQWWVOB-UHFFFAOYSA-N
XLogP23.11
TPSA147.70 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds55
Heavy Atoms106
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001501.44
LogP ≤ 523.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one (CID 157306330) is 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one is CCCCCCCCC(=O)N1CCOCC1.CCCCCCCCCCC(=O)N1CC(C)OC(C)C1.CCCCCCCCCCCCC(=O)N1CC(C)OC(C)C1.CCCCCCCCCCCCCC(=O)N1CC(C)OC(C)C1.CCCCCCCCCCCCCCCCCC(=O)N1CCOCC1.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one?
The InChIKey is BCNCHIMWQWWVOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H43NO2.C20H39NO2.C19H37NO2.C17H33NO2.C13H25NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(24)23-18-20-25-21-19-23;1-4-5-6-7-8-9-10-11-12-13-14-15-20(22)21-16-18(2)23-19(3)17-21;1-4-5-6-7-8-9-10-11-12-13-14-19(21)20-15-17(2)22-18(3)16-20;1-4-5-6-7-8-9-10-11-12-17(19)18-13-15(2)20-16(3)14-18;1-2-3-4-5-6-7-8-13(15)14-9-11-16-12-10-14/h2-21H2,1H3;18-19H,4-17H2,1-3H3;17-18H,4-16H2,1-3H3;15-16H,4-14H2,1-3H3;2-12H2,1H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one?
1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one has a molecular weight of 1501.44 g/mol, XLogP of 23.11, 55 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylmorpholin-4-yl)tetradecan-1-one;1-(2,6-dimethylmorpholin-4-yl)tridecan-1-one;1-(2,6-dimethylmorpholin-4-yl)undecan-1-one;1-morpholin-4-ylnonan-1-one;1-morpholin-4-yloctadecan-1-one is sourced from PubChem (CID 157306330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).