N-(4,6-dimethylnonyl)-N-ethenylformamide

C14H27NO — CID 167215588

IUPACN-(4,6-dimethylnonyl)-N-ethenylformamide
SMILESC=CN(C=O)CCCC(C)CC(C)CCC
InChIInChI=1S/C14H27NO/c1-5-8-13(3)11-14(4)9-7-10-15(6-2)12-16/h6,12-14H,2,5,7-11H2,1,3-4H3
InChIKeyYUNSVKCLADUDEH-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.83
Rot. Bonds10

About N-(4,6-dimethylnonyl)-N-ethenylformamide

N-(4,6-dimethylnonyl)-N-ethenylformamide (PubChem CID 167215588) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-(4,6-dimethylnonyl)-N-ethenylformamide.

Molecular Properties

Compound NameN-(4,6-dimethylnonyl)-N-ethenylformamide
PubChem CID167215588
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-(4,6-dimethylnonyl)-N-ethenylformamide
SMILESC=CN(C=O)CCCC(C)CC(C)CCC
InChIInChI=1S/C14H27NO/c1-5-8-13(3)11-14(4)9-7-10-15(6-2)12-16/h6,12-14H,2,5,7-11H2,1,3-4H3
InChIKeyYUNSVKCLADUDEH-UHFFFAOYSA-N
XLogP3.83
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethylnonyl)-N-ethenylformamide?
The IUPAC name of N-(4,6-dimethylnonyl)-N-ethenylformamide (CID 167215588) is N-(4,6-dimethylnonyl)-N-ethenylformamide.
What is the SMILES notation for N-(4,6-dimethylnonyl)-N-ethenylformamide?
The canonical SMILES for N-(4,6-dimethylnonyl)-N-ethenylformamide is C=CN(C=O)CCCC(C)CC(C)CCC.
What is the InChIKey of N-(4,6-dimethylnonyl)-N-ethenylformamide?
The InChIKey is YUNSVKCLADUDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-5-8-13(3)11-14(4)9-7-10-15(6-2)12-16/h6,12-14H,2,5,7-11H2,1,3-4H3.
What are the key properties of N-(4,6-dimethylnonyl)-N-ethenylformamide?
N-(4,6-dimethylnonyl)-N-ethenylformamide has a molecular weight of 225.38 g/mol, XLogP of 3.83, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethylnonyl)-N-ethenylformamide is sourced from PubChem (CID 167215588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).