N-(2-hexoxyethoxy)propan-1-amine

C11H25NO2 — CID 88792520

IUPACN-(2-hexoxyethoxy)propan-1-amine
SMILESCCCCCCOCCONCCC
InChIInChI=1S/C11H25NO2/c1-3-5-6-7-9-13-10-11-14-12-8-4-2/h12H,3-11H2,1-2H3
InChIKeyLNNUOIONFLTHFS-UHFFFAOYSA-N
MW203.33 g/mol
LogP2.51
Rot. Bonds11

About N-(2-hexoxyethoxy)propan-1-amine

N-(2-hexoxyethoxy)propan-1-amine (PubChem CID 88792520) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is N-(2-hexoxyethoxy)propan-1-amine.

Molecular Properties

Compound NameN-(2-hexoxyethoxy)propan-1-amine
PubChem CID88792520
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC NameN-(2-hexoxyethoxy)propan-1-amine
SMILESCCCCCCOCCONCCC
InChIInChI=1S/C11H25NO2/c1-3-5-6-7-9-13-10-11-14-12-8-4-2/h12H,3-11H2,1-2H3
InChIKeyLNNUOIONFLTHFS-UHFFFAOYSA-N
XLogP2.51
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-octadecoxypropan-1-amine
CID 18519352
3-dodecoxy-N-tetradecoxypropan-1-amine
CID 87645164
cyclopropane;N-dodecoxypropan-1-amine
CID 130367915
CID 159860963
CID 159860963
1-[2-[2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]heptane
CID 150797704
1-[2-(2-tetradecoxyethoxy)ethoxy]tetradecane
CID 10743953
1-[2-[2-[2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octane
CID 151767279
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octadecane
CID 86345710
1-(2-octoxyethoxy)octane
CID 12711862
1-[2-(2-heptoxyethoxy)ethoxy]heptane
CID 14402381
1-[2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethoxy]octane
CID 86197097
1-(2-decoxyethoxy)decane
CID 14009354

Frequently Asked Questions

What is the IUPAC name of N-(2-hexoxyethoxy)propan-1-amine?
The IUPAC name of N-(2-hexoxyethoxy)propan-1-amine (CID 88792520) is N-(2-hexoxyethoxy)propan-1-amine.
What is the SMILES notation for N-(2-hexoxyethoxy)propan-1-amine?
The canonical SMILES for N-(2-hexoxyethoxy)propan-1-amine is CCCCCCOCCONCCC.
What is the InChIKey of N-(2-hexoxyethoxy)propan-1-amine?
The InChIKey is LNNUOIONFLTHFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-3-5-6-7-9-13-10-11-14-12-8-4-2/h12H,3-11H2,1-2H3.
What are the key properties of N-(2-hexoxyethoxy)propan-1-amine?
N-(2-hexoxyethoxy)propan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 2.51, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hexoxyethoxy)propan-1-amine is sourced from PubChem (CID 88792520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).