N-ethyl-2-(oxan-2-yl)ethanamine

C9H19NO — CID 62549165

IUPACN-ethyl-2-(oxan-2-yl)ethanamine
SMILESCCNCCC1CCCCO1
InChIInChI=1S/C9H19NO/c1-2-10-7-6-9-5-3-4-8-11-9/h9-10H,2-8H2,1H3
InChIKeyCXUNYWIFMMXHJR-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.56
Rot. Bonds4

About N-ethyl-2-(oxan-2-yl)ethanamine

N-ethyl-2-(oxan-2-yl)ethanamine (PubChem CID 62549165) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-ethyl-2-(oxan-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(oxan-2-yl)ethanamine
PubChem CID62549165
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-ethyl-2-(oxan-2-yl)ethanamine
SMILESCCNCCC1CCCCO1
InChIInChI=1S/C9H19NO/c1-2-10-7-6-9-5-3-4-8-11-9/h9-10H,2-8H2,1H3
InChIKeyCXUNYWIFMMXHJR-UHFFFAOYSA-N
XLogP1.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-ethyl-2-(oxan-2-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine
CID 62834649
N-[(4-ethylphenyl)methyl]-2-(oxan-2-yl)ethanamine
CID 113362830
N-[2-(oxolan-2-yl)ethyl]nonan-1-amine
CID 61039120
N-ethyl-5-(oxan-2-ylmethoxy)pentan-1-amine
CID 62446418
N-[2-(oxan-2-yl)ethyl]cyclopropanamine
CID 62548830
N-[(5-ethylthiophen-2-yl)methyl]-2-(oxan-2-yl)ethanamine
CID 113362826
N-[2-(oxolan-2-yl)ethyl]prop-2-yn-1-amine
CID 62141075
N-[2-(ethylamino)ethyl]-1-(oxan-2-yl)methanesulfonamide
CID 119973445
2-(oxolan-2-yl)-N-(2-propoxyethyl)ethanamine
CID 106451738
N-(oxan-2-ylmethyl)propan-1-amine
CID 13288217
N-[2-(oxolan-2-yl)ethyl]but-2-yn-1-amine
CID 62311153
2-[3-(oxan-2-yl)propyl]oxane
CID 71182925

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(oxan-2-yl)ethanamine?
The IUPAC name of N-ethyl-2-(oxan-2-yl)ethanamine (CID 62549165) is N-ethyl-2-(oxan-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(oxan-2-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(oxan-2-yl)ethanamine is CCNCCC1CCCCO1.
What is the InChIKey of N-ethyl-2-(oxan-2-yl)ethanamine?
The InChIKey is CXUNYWIFMMXHJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-2-10-7-6-9-5-3-4-8-11-9/h9-10H,2-8H2,1H3.
What are the key properties of N-ethyl-2-(oxan-2-yl)ethanamine?
N-ethyl-2-(oxan-2-yl)ethanamine has a molecular weight of 157.26 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(oxan-2-yl)ethanamine is sourced from PubChem (CID 62549165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).