(Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one

C19H35NO2 — CID 129233324

IUPAC(Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one
SMILESCC(C)CC(C)(C)/C=C\C(C)CC(C)C(=O)N1CCOCC1
InChIInChI=1S/C19H35NO2/c1-15(2)14-19(5,6)8-7-16(3)13-17(4)18(21)20-9-11-22-12-10-20/h7-8,15-17H,9-14H2,1-6H3/b8-7-
InChIKeyZNWIAKQETPYRQF-FPLPWBNLSA-N
MW309.49 g/mol
LogP4.14
Rot. Bonds7

About (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one

(Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one (PubChem CID 129233324) has the molecular formula C19H35NO2 and a molecular weight of 309.49 g/mol. Its IUPAC name is (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one.

Molecular Properties

Compound Name(Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one
PubChem CID129233324
Molecular FormulaC19H35NO2
Molecular Weight309.49 g/mol
Exact Mass309.27
IUPAC Name(Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one
SMILESCC(C)CC(C)(C)/C=C\C(C)CC(C)C(=O)N1CCOCC1
InChIInChI=1S/C19H35NO2/c1-15(2)14-19(5,6)8-7-16(3)13-17(4)18(21)20-9-11-22-12-10-20/h7-8,15-17H,9-14H2,1-6H3/b8-7-
InChIKeyZNWIAKQETPYRQF-FPLPWBNLSA-N
XLogP4.14
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.49
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one?
The IUPAC name of (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one (CID 129233324) is (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one.
What is the SMILES notation for (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one?
The canonical SMILES for (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one is CC(C)CC(C)(C)/C=C\C(C)CC(C)C(=O)N1CCOCC1.
What is the InChIKey of (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one?
The InChIKey is ZNWIAKQETPYRQF-FPLPWBNLSA-N. The full InChI is InChI=1S/C19H35NO2/c1-15(2)14-19(5,6)8-7-16(3)13-17(4)18(21)20-9-11-22-12-10-20/h7-8,15-17H,9-14H2,1-6H3/b8-7-.
What are the key properties of (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one?
(Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one has a molecular weight of 309.49 g/mol, XLogP of 4.14, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2,4,7,7,9-pentamethyl-1-morpholin-4-yldec-5-en-1-one is sourced from PubChem (CID 129233324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).