10-ethoxy-9,9-dimethyldecan-1-amine

C14H31NO — CID 3085386

IUPAC10-ethoxy-9,9-dimethyldecan-1-amine
SMILESCCOCC(C)(C)CCCCCCCCN
InChIInChI=1S/C14H31NO/c1-4-16-13-14(2,3)11-9-7-5-6-8-10-12-15/h4-13,15H2,1-3H3
InChIKeyYZDDMFFTOVVVMX-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.74
Rot. Bonds11

About 10-ethoxy-9,9-dimethyldecan-1-amine

10-ethoxy-9,9-dimethyldecan-1-amine (PubChem CID 3085386) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is 10-ethoxy-9,9-dimethyldecan-1-amine.

Molecular Properties

Compound Name10-ethoxy-9,9-dimethyldecan-1-amine
PubChem CID3085386
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC Name10-ethoxy-9,9-dimethyldecan-1-amine
SMILESCCOCC(C)(C)CCCCCCCCN
InChIInChI=1S/C14H31NO/c1-4-16-13-14(2,3)11-9-7-5-6-8-10-12-15/h4-13,15H2,1-3H3
InChIKeyYZDDMFFTOVVVMX-UHFFFAOYSA-N
XLogP3.74
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 10-ethoxy-9,9-dimethyldecan-1-amine?
The IUPAC name of 10-ethoxy-9,9-dimethyldecan-1-amine (CID 3085386) is 10-ethoxy-9,9-dimethyldecan-1-amine.
What is the SMILES notation for 10-ethoxy-9,9-dimethyldecan-1-amine?
The canonical SMILES for 10-ethoxy-9,9-dimethyldecan-1-amine is CCOCC(C)(C)CCCCCCCCN.
What is the InChIKey of 10-ethoxy-9,9-dimethyldecan-1-amine?
The InChIKey is YZDDMFFTOVVVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-4-16-13-14(2,3)11-9-7-5-6-8-10-12-15/h4-13,15H2,1-3H3.
What are the key properties of 10-ethoxy-9,9-dimethyldecan-1-amine?
10-ethoxy-9,9-dimethyldecan-1-amine has a molecular weight of 229.41 g/mol, XLogP of 3.74, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-ethoxy-9,9-dimethyldecan-1-amine is sourced from PubChem (CID 3085386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).