N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene

C16H31NO — CID 143346048

IUPACN,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene
SMILESC=C/C=C\C(=C/CC)CC.CC.CC(=O)N(C)C
InChIInChI=1S/C10H16.C4H9NO.C2H6/c1-4-7-9-10(6-3)8-5-2;1-4(6)5(2)3;1-2/h4,7-9H,1,5-6H2,2-3H3;1-3H3;1-2H3/b9-7-,10-8-;;
InChIKeyNZCQVWIATYKURV-RXRQIEPESA-N
MW253.43 g/mol
LogP4.60
Rot. Bonds4

About N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene

N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene (PubChem CID 143346048) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene.

Molecular Properties

Compound NameN,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene
PubChem CID143346048
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC NameN,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene
SMILESC=C/C=C\C(=C/CC)CC.CC.CC(=O)N(C)C
InChIInChI=1S/C10H16.C4H9NO.C2H6/c1-4-7-9-10(6-3)8-5-2;1-4(6)5(2)3;1-2/h4,7-9H,1,5-6H2,2-3H3;1-3H3;1-2H3/b9-7-,10-8-;;
InChIKeyNZCQVWIATYKURV-RXRQIEPESA-N
XLogP4.60
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene 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,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene?
The IUPAC name of N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene (CID 143346048) is N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene.
What is the SMILES notation for N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene?
The canonical SMILES for N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene is C=C/C=C\C(=C/CC)CC.CC.CC(=O)N(C)C.
What is the InChIKey of N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene?
The InChIKey is NZCQVWIATYKURV-RXRQIEPESA-N. The full InChI is InChI=1S/C10H16.C4H9NO.C2H6/c1-4-7-9-10(6-3)8-5-2;1-4(6)5(2)3;1-2/h4,7-9H,1,5-6H2,2-3H3;1-3H3;1-2H3/b9-7-,10-8-;;.
What are the key properties of N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene?
N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene has a molecular weight of 253.43 g/mol, XLogP of 4.60, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylacetamide;ethane;(3Z,5Z)-5-ethylocta-1,3,5-triene is sourced from PubChem (CID 143346048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).