N-(2-cyclopentyloxyethyl)oxan-4-amine

C12H23NO2 — CID 63099341

IUPACN-(2-cyclopentyloxyethyl)oxan-4-amine
SMILESC1CCC(OCCNC2CCOCC2)C1
InChIInChI=1S/C12H23NO2/c1-2-4-12(3-1)15-10-7-13-11-5-8-14-9-6-11/h11-13H,1-10H2
InChIKeyPIPLGAHEMBODDR-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.71
Rot. Bonds5

About N-(2-cyclopentyloxyethyl)oxan-4-amine

N-(2-cyclopentyloxyethyl)oxan-4-amine (PubChem CID 63099341) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-(2-cyclopentyloxyethyl)oxan-4-amine.

Molecular Properties

Compound NameN-(2-cyclopentyloxyethyl)oxan-4-amine
PubChem CID63099341
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-(2-cyclopentyloxyethyl)oxan-4-amine
SMILESC1CCC(OCCNC2CCOCC2)C1
InChIInChI=1S/C12H23NO2/c1-2-4-12(3-1)15-10-7-13-11-5-8-14-9-6-11/h11-13H,1-10H2
InChIKeyPIPLGAHEMBODDR-UHFFFAOYSA-N
XLogP1.71
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.71
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-cyclohexyloxyethyl)cyclohexanamine
CID 62567044
3-methyl-N-[2-(oxan-4-yloxy)ethyl]cyclohexan-1-amine
CID 62583661
N-(2-cyclopentyloxyethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79903516
N-(2-cycloheptyloxyethyl)-4-methylcyclohexan-1-amine
CID 62583471
N-(2-methoxyethyl)oxan-4-amine;hydrochloride
CID 110204327
N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine
CID 104871151
N-(2-cyclopentyloxyethyl)spiro[4.5]decan-8-amine
CID 114817665
N-(2-ethoxyethyl)oxan-4-amine
CID 43608661
N-(2-cyclobutyloxyethyl)-4-methylcyclohexan-1-amine
CID 62584943
N-(3-cycloheptyloxypropyl)cyclohexanamine
CID 62583654
N-(3-cyclohexyloxypropyl)cyclopentanamine
CID 28720049
N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine
CID 115336994

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyethyl)oxan-4-amine?
The IUPAC name of N-(2-cyclopentyloxyethyl)oxan-4-amine (CID 63099341) is N-(2-cyclopentyloxyethyl)oxan-4-amine.
What is the SMILES notation for N-(2-cyclopentyloxyethyl)oxan-4-amine?
The canonical SMILES for N-(2-cyclopentyloxyethyl)oxan-4-amine is C1CCC(OCCNC2CCOCC2)C1.
What is the InChIKey of N-(2-cyclopentyloxyethyl)oxan-4-amine?
The InChIKey is PIPLGAHEMBODDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-2-4-12(3-1)15-10-7-13-11-5-8-14-9-6-11/h11-13H,1-10H2.
What are the key properties of N-(2-cyclopentyloxyethyl)oxan-4-amine?
N-(2-cyclopentyloxyethyl)oxan-4-amine has a molecular weight of 213.32 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyethyl)oxan-4-amine is sourced from PubChem (CID 63099341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).