2-tetradecoxyethanamine

C16H35NO — CID 18672783

IUPAC2-tetradecoxyethanamine
SMILESCCCCCCCCCCCCCCOCCN
InChIInChI=1S/C16H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-16-14-17/h2-17H2,1H3
InChIKeyVDKIKEMSODDARD-UHFFFAOYSA-N
MW257.46 g/mol
LogP4.66
Rot. Bonds15

About 2-tetradecoxyethanamine

2-tetradecoxyethanamine (PubChem CID 18672783) has the molecular formula C16H35NO and a molecular weight of 257.46 g/mol. Its IUPAC name is 2-tetradecoxyethanamine.

Molecular Properties

Compound Name2-tetradecoxyethanamine
PubChem CID18672783
Molecular FormulaC16H35NO
Molecular Weight257.46 g/mol
Exact Mass257.27
IUPAC Name2-tetradecoxyethanamine
SMILESCCCCCCCCCCCCCCOCCN
InChIInChI=1S/C16H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-16-14-17/h2-17H2,1H3
InChIKeyVDKIKEMSODDARD-UHFFFAOYSA-N
XLogP4.66
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.46
LogP ≤ 54.66
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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Related Compounds

3-(Octyloxy)propanamine
CID 85192
Laurixamine
CID 65596
3-(Decyloxy)propan-1-amine
CID 82088
2,3-Didodecoxypropan-1-amine
CID 10180941
1-Propanamine, 3-(hexadecyloxy)-
CID 78406
1-Propanamine, 3-(tetradecyloxy)-
CID 82089
2-(2-(Dodecyloxy)-ethoxy)-ethylamine
CID 4425284
3-(Tridecyloxy)-1-propanamine
CID 84589
2-Tetradecoxypropane-1,3-diamine;dihydrochloride
CID 49796506
2-Hexadecoxyethanamine
CID 17914362
2-(Dodecyloxy)ethan-1-amine
CID 18672799
Bis-(2-decyloxy-ethyl)-amine
CID 6421831

Frequently Asked Questions

What is the IUPAC name of 2-tetradecoxyethanamine?
The IUPAC name of 2-tetradecoxyethanamine (CID 18672783) is 2-tetradecoxyethanamine.
What is the SMILES notation for 2-tetradecoxyethanamine?
The canonical SMILES for 2-tetradecoxyethanamine is CCCCCCCCCCCCCCOCCN.
What is the InChIKey of 2-tetradecoxyethanamine?
The InChIKey is VDKIKEMSODDARD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-16-14-17/h2-17H2,1H3.
What are the key properties of 2-tetradecoxyethanamine?
2-tetradecoxyethanamine has a molecular weight of 257.46 g/mol, XLogP of 4.66, 15 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tetradecoxyethanamine is sourced from PubChem (CID 18672783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).