N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide

C22H37NO — CID 14834753

IUPACN-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide
SMILESCC(=O)NC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C22H37NO/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-23-22(6)24/h10,12,14,16H,7-9,11,13,15,17H2,1-6H3,(H,23,24)/b19-12+,20-14+,21-16+
InChIKeyGSTRVCHSVMEJAJ-RFRQLJORSA-N
MW331.54 g/mol
LogP6.27
Rot. Bonds11

About N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide

N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide (PubChem CID 14834753) has the molecular formula C22H37NO and a molecular weight of 331.54 g/mol. Its IUPAC name is N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide.

Molecular Properties

Compound NameN-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide
PubChem CID14834753
Molecular FormulaC22H37NO
Molecular Weight331.54 g/mol
Exact Mass331.29
IUPAC NameN-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide
SMILESCC(=O)NC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C22H37NO/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-23-22(6)24/h10,12,14,16H,7-9,11,13,15,17H2,1-6H3,(H,23,24)/b19-12+,20-14+,21-16+
InChIKeyGSTRVCHSVMEJAJ-RFRQLJORSA-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'}

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Frequently Asked Questions

What is the IUPAC name of N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide?
The IUPAC name of N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide (CID 14834753) is N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide.
What is the SMILES notation for N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide?
The canonical SMILES for N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide is CC(=O)NC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C.
What is the InChIKey of N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide?
The InChIKey is GSTRVCHSVMEJAJ-RFRQLJORSA-N. The full InChI is InChI=1S/C22H37NO/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-23-22(6)24/h10,12,14,16H,7-9,11,13,15,17H2,1-6H3,(H,23,24)/b19-12+,20-14+,21-16+.
What are the key properties of N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide?
N-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]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-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]acetamide is sourced from PubChem (CID 14834753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).