N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine

C12H23NO2 — CID 115336994

IUPACN-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine
SMILESCC1OCCC1NCCOC1CCCC1
InChIInChI=1S/C12H23NO2/c1-10-12(6-8-14-10)13-7-9-15-11-4-2-3-5-11/h10-13H,2-9H2,1H3
InChIKeyIVTBAKOQDFIQCO-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.71
Rot. Bonds5

About N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine

N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine (PubChem CID 115336994) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine.

Molecular Properties

Compound NameN-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine
PubChem CID115336994
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine
SMILESCC1OCCC1NCCOC1CCCC1
InChIInChI=1S/C12H23NO2/c1-10-12(6-8-14-10)13-7-9-15-11-4-2-3-5-11/h10-13H,2-9H2,1H3
InChIKeyIVTBAKOQDFIQCO-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-(3-cyclohexyloxypropyl)-2-methyloxolan-3-amine
CID 113289548
(2R,3R)-N-(3-cyclohexyloxypropyl)-2-methyloxolan-3-amine
CID 124568299
(2S,3R)-N-(3-methoxypropyl)-2-methyloxolan-3-amine
CID 97358081
N-(2-cyclopentyloxyethyl)oxan-4-amine
CID 63099341
2-[[(2S,3S)-2-methyloxolan-3-yl]amino]ethanol
CID 99633545
2-methyl-N-propyloxolan-3-amine;hydrochloride
CID 146154013
N-(2-cycloheptyloxyethyl)-4-methylcyclohexan-1-amine
CID 62583471
N-(2-cyclohexyloxyethyl)cyclohexanamine
CID 62567044
2-methyl-N-(3-propoxypropyl)oxolan-3-amine
CID 82940328
trans-(1R,2R)-2-(2-cyclopentyloxyethylamino)cyclopentan-1-ol
CID 102733484
(2S,3R)-2-methyl-N-(2-methylpropyl)oxolan-3-amine
CID 97358057
(2S,3R)-2-methyl-N-pentyloxolan-3-amine
CID 97358110

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine?
The IUPAC name of N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine (CID 115336994) is N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine.
What is the SMILES notation for N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine?
The canonical SMILES for N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine is CC1OCCC1NCCOC1CCCC1.
What is the InChIKey of N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine?
The InChIKey is IVTBAKOQDFIQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-10-12(6-8-14-10)13-7-9-15-11-4-2-3-5-11/h10-13H,2-9H2,1H3.
What are the key properties of N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-amine?
N-(2-cyclopentyloxyethyl)-2-methyloxolan-3-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)-2-methyloxolan-3-amine is sourced from PubChem (CID 115336994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).