N-(2-ethoxyethyl)oxan-3-amine

C9H19NO2 — CID 63363906

IUPACN-(2-ethoxyethyl)oxan-3-amine
SMILESCCOCCNC1CCCOC1
InChIInChI=1S/C9H19NO2/c1-2-11-7-5-10-9-4-3-6-12-8-9/h9-10H,2-8H2,1H3
InChIKeyOGTLCDXARSAYKT-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.79
Rot. Bonds5

About N-(2-ethoxyethyl)oxan-3-amine

N-(2-ethoxyethyl)oxan-3-amine (PubChem CID 63363906) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N-(2-ethoxyethyl)oxan-3-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)oxan-3-amine
PubChem CID63363906
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN-(2-ethoxyethyl)oxan-3-amine
SMILESCCOCCNC1CCCOC1
InChIInChI=1S/C9H19NO2/c1-2-11-7-5-10-9-4-3-6-12-8-9/h9-10H,2-8H2,1H3
InChIKeyOGTLCDXARSAYKT-UHFFFAOYSA-N
XLogP0.79
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(oxolan-3-ylmethoxy)ethyl]oxan-3-amine
CID 115718476
N-(2-ethoxyethyl)oxan-4-amine
CID 43608661
N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine
CID 63099695
ethyl 3-(oxan-3-ylamino)propanoate
CID 63363910
ethyl N-[2-(oxan-3-ylamino)ethyl]carbamate
CID 115889525
N-(2-methoxyethyl)oxolan-3-amine
CID 63331660
trans-(1R,3R)-N-(2-ethoxyethyl)-3-methylcyclohexan-1-amine
CID 93051534
2-[2-(oxolan-3-ylamino)ethoxy]ethanol
CID 63331737
N-methyl-N'-(oxan-3-yl)methanediamine
CID 139447312
N-(2-ethoxyethyl)-4-ethylcycloheptan-1-amine
CID 65084124
3-ethoxy-N-(oxan-3-ylmethyl)propan-1-amine
CID 63738389
N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine
CID 43387964

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)oxan-3-amine?
The IUPAC name of N-(2-ethoxyethyl)oxan-3-amine (CID 63363906) is N-(2-ethoxyethyl)oxan-3-amine.
What is the SMILES notation for N-(2-ethoxyethyl)oxan-3-amine?
The canonical SMILES for N-(2-ethoxyethyl)oxan-3-amine is CCOCCNC1CCCOC1.
What is the InChIKey of N-(2-ethoxyethyl)oxan-3-amine?
The InChIKey is OGTLCDXARSAYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-2-11-7-5-10-9-4-3-6-12-8-9/h9-10H,2-8H2,1H3.
What are the key properties of N-(2-ethoxyethyl)oxan-3-amine?
N-(2-ethoxyethyl)oxan-3-amine has a molecular weight of 173.26 g/mol, XLogP of 0.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)oxan-3-amine is sourced from PubChem (CID 63363906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).