(Z)-tetratriacont-9-enamide

C34H67NO — CID 86624387

IUPAC(Z)-tetratriacont-9-enamide
SMILESCCCCCCCCCCCCCCCCCCCCCCCC/C=C\CCCCCCCC(N)=O
InChIInChI=1S/C34H67NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34(35)36/h25-26H,2-24,27-33H2,1H3,(H2,35,36)/b26-25-
InChIKeyGPAYSHQGOZDCQX-QPLCGJKRSA-N
MW505.92 g/mol
LogP11.75
Rot. Bonds31

About (Z)-tetratriacont-9-enamide

(Z)-tetratriacont-9-enamide (PubChem CID 86624387) has the molecular formula C34H67NO and a molecular weight of 505.92 g/mol. Its IUPAC name is (Z)-tetratriacont-9-enamide.

Molecular Properties

Compound Name(Z)-tetratriacont-9-enamide
PubChem CID86624387
Molecular FormulaC34H67NO
Molecular Weight505.92 g/mol
Exact Mass505.52
IUPAC Name(Z)-tetratriacont-9-enamide
SMILESCCCCCCCCCCCCCCCCCCCCCCCC/C=C\CCCCCCCC(N)=O
InChIInChI=1S/C34H67NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34(35)36/h25-26H,2-24,27-33H2,1H3,(H2,35,36)/b26-25-
InChIKeyGPAYSHQGOZDCQX-QPLCGJKRSA-N
XLogP11.75
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds31
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500505.92
LogP ≤ 511.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

octadec-9-enamide
CID 75990485
(E)-icos-11-enamide
CID 5365373
octadec-8-enamide
CID 57212690
(Z)-tricos-15-enamide
CID 155109212
(Z)-(113C)octadec-9-enamide
CID 175811454
(Z)-octadec-9-enamide;platinum
CID 174872668
(Z)-octadec-9-enamide;hydrobromide
CID 146504042
indigane;(Z)-octadec-9-enamide
CID 174921402
ethanamine;(Z)-octadec-9-enamide
CID 174881781
mercury;(Z)-octadec-9-enamide;hydrochloride
CID 175499195
(Z)-octadec-9-enamide;propan-1-ol
CID 174914657
calcium;(Z)-octadec-9-enamide;carbonate
CID 87780196

Frequently Asked Questions

What is the IUPAC name of (Z)-tetratriacont-9-enamide?
The IUPAC name of (Z)-tetratriacont-9-enamide (CID 86624387) is (Z)-tetratriacont-9-enamide.
What is the SMILES notation for (Z)-tetratriacont-9-enamide?
The canonical SMILES for (Z)-tetratriacont-9-enamide is CCCCCCCCCCCCCCCCCCCCCCCC/C=C\CCCCCCCC(N)=O.
What is the InChIKey of (Z)-tetratriacont-9-enamide?
The InChIKey is GPAYSHQGOZDCQX-QPLCGJKRSA-N. The full InChI is InChI=1S/C34H67NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34(35)36/h25-26H,2-24,27-33H2,1H3,(H2,35,36)/b26-25-.
What are the key properties of (Z)-tetratriacont-9-enamide?
(Z)-tetratriacont-9-enamide has a molecular weight of 505.92 g/mol, XLogP of 11.75, 31 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-tetratriacont-9-enamide is sourced from PubChem (CID 86624387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).