N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide

C22H37NO — CID 11088867

IUPACN-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide
SMILESC=CC(C)(CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)NC(C)=O
InChIInChI=1S/C22H37NO/c1-8-22(7,23-21(6)24)17-11-16-20(5)15-10-14-19(4)13-9-12-18(2)3/h8,12,14,16H,1,9-11,13,15,17H2,2-7H3,(H,23,24)/b19-14+,20-16+
InChIKeyGQQXOWVZTSATIY-XHGFWWIISA-N
MW331.54 g/mol
LogP6.27
Rot. Bonds11

About N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide

N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide (PubChem CID 11088867) has the molecular formula C22H37NO and a molecular weight of 331.54 g/mol. Its IUPAC name is N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide.

Molecular Properties

Compound NameN-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide
PubChem CID11088867
Molecular FormulaC22H37NO
Molecular Weight331.54 g/mol
Exact Mass331.29
IUPAC NameN-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide
SMILESC=CC(C)(CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)NC(C)=O
InChIInChI=1S/C22H37NO/c1-8-22(7,23-21(6)24)17-11-16-20(5)15-10-14-19(4)13-9-12-18(2)3/h8,12,14,16H,1,9-11,13,15,17H2,2-7H3,(H,23,24)/b19-14+,20-16+
InChIKeyGQQXOWVZTSATIY-XHGFWWIISA-N
XLogP6.27
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.54
LogP ≤ 56.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide?
The IUPAC name of N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide (CID 11088867) is N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide.
What is the SMILES notation for N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide?
The canonical SMILES for N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide is C=CC(C)(CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)NC(C)=O.
What is the InChIKey of N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide?
The InChIKey is GQQXOWVZTSATIY-XHGFWWIISA-N. The full InChI is InChI=1S/C22H37NO/c1-8-22(7,23-21(6)24)17-11-16-20(5)15-10-14-19(4)13-9-12-18(2)3/h8,12,14,16H,1,9-11,13,15,17H2,2-7H3,(H,23,24)/b19-14+,20-16+.
What are the key properties of N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide?
N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide has a molecular weight of 331.54 g/mol, XLogP of 6.27, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6E,10E)-3,7,11,15-tetramethylhexadeca-1,6,10,14-tetraen-3-yl]acetamide is sourced from PubChem (CID 11088867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).