N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine

C20H31NO2 — CID 119034256

IUPACN-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine
SMILESCC(NCCOCC1CCCO1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C20H31NO2/c1-17(21-13-15-22-16-19-10-7-14-23-19)20(11-5-6-12-20)18-8-3-2-4-9-18/h2-4,8-9,17,19,21H,5-7,10-16H2,1H3
InChIKeyHQFZEECYLGEPCI-UHFFFAOYSA-N
MW317.47 g/mol
LogP3.67
Rot. Bonds8

About N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine

N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine (PubChem CID 119034256) has the molecular formula C20H31NO2 and a molecular weight of 317.47 g/mol. Its IUPAC name is N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine.

Molecular Properties

Compound NameN-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine
PubChem CID119034256
Molecular FormulaC20H31NO2
Molecular Weight317.47 g/mol
Exact Mass317.24
IUPAC NameN-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine
SMILESCC(NCCOCC1CCCO1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C20H31NO2/c1-17(21-13-15-22-16-19-10-7-14-23-19)20(11-5-6-12-20)18-8-3-2-4-9-18/h2-4,8-9,17,19,21H,5-7,10-16H2,1H3
InChIKeyHQFZEECYLGEPCI-UHFFFAOYSA-N
XLogP3.67
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)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-[2-(oxolan-2-ylmethoxy)ethyl]butan-2-amine
CID 62572646
N-[1-(1-phenylcyclopentyl)ethyl]propan-1-amine
CID 63079548
N-(1-cyclopropylethyl)-3-(oxolan-2-ylmethoxy)propan-1-amine
CID 43205697
2-chloro-N-[3-(oxolan-2-ylmethoxy)propyl]-2-phenylacetamide
CID 61251530
3-(oxolan-2-ylmethoxy)-N-(2-phenylethyl)propan-1-amine
CID 43182521
N-[3-(oxolan-2-ylmethoxy)propyl]-3-phenylpropan-1-amine
CID 43182561
2-methyl-1-[2-(oxolan-2-ylmethoxy)ethyl]-3-(1-phenylethyl)guanidine;hydroiodide
CID 111545682
N-[1-(2-methylpyrazol-3-yl)ethyl]-3-(oxolan-2-ylmethoxy)propan-1-amine
CID 106756981
N-[3-[[(2S)-oxolan-2-yl]methoxy]propyl]benzamide
CID 94598600
N-[1-(4-iodophenyl)ethyl]-3-(oxolan-2-ylmethoxy)propan-1-amine
CID 43770023
3-(oxolan-2-yl)-1-(1-phenylcyclohexyl)propan-1-amine
CID 65164463
1,1-difluoro-N-[3-(oxolan-2-ylmethoxy)propyl]propan-2-amine
CID 102868081

Frequently Asked Questions

What is the IUPAC name of N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine?
The IUPAC name of N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine (CID 119034256) is N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine.
What is the SMILES notation for N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine?
The canonical SMILES for N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine is CC(NCCOCC1CCCO1)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine?
The InChIKey is HQFZEECYLGEPCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31NO2/c1-17(21-13-15-22-16-19-10-7-14-23-19)20(11-5-6-12-20)18-8-3-2-4-9-18/h2-4,8-9,17,19,21H,5-7,10-16H2,1H3.
What are the key properties of N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine?
N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine has a molecular weight of 317.47 g/mol, XLogP of 3.67, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(oxolan-2-ylmethoxy)ethyl]-1-(1-phenylcyclopentyl)ethanamine is sourced from PubChem (CID 119034256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).