2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide

C15H27NO — CID 91465696

IUPAC2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide
SMILESCC=C(C)C(C)=C(C)C(C)(C)NC(=O)C(C)C
InChIInChI=1S/C15H27NO/c1-9-11(4)12(5)13(6)15(7,8)16-14(17)10(2)3/h9-10H,1-8H3,(H,16,17)
InChIKeyHUICGWYNUYEZIP-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.84
Rot. Bonds4

About 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide

2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide (PubChem CID 91465696) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide
PubChem CID91465696
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC Name2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide
SMILESCC=C(C)C(C)=C(C)C(C)(C)NC(=O)C(C)C
InChIInChI=1S/C15H27NO/c1-9-11(4)12(5)13(6)15(7,8)16-14(17)10(2)3/h9-10H,1-8H3,(H,16,17)
InChIKeyHUICGWYNUYEZIP-UHFFFAOYSA-N
XLogP3.84
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide?
The IUPAC name of 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide (CID 91465696) is 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide?
The canonical SMILES for 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide is CC=C(C)C(C)=C(C)C(C)(C)NC(=O)C(C)C.
What is the InChIKey of 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide?
The InChIKey is HUICGWYNUYEZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c1-9-11(4)12(5)13(6)15(7,8)16-14(17)10(2)3/h9-10H,1-8H3,(H,16,17).
What are the key properties of 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide?
2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide has a molecular weight of 237.39 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide is sourced from PubChem (CID 91465696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).