N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine

C12H25NO2 — CID 65161819

IUPACN-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine
SMILESCCNC(CCCC1CCCO1)COC
InChIInChI=1S/C12H25NO2/c1-3-13-11(10-14-2)6-4-7-12-8-5-9-15-12/h11-13H,3-10H2,1-2H3
InChIKeyPFMGVHDLODQICZ-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.96
Rot. Bonds8

About N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine

N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine (PubChem CID 65161819) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine
PubChem CID65161819
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC NameN-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine
SMILESCCNC(CCCC1CCCO1)COC
InChIInChI=1S/C12H25NO2/c1-3-13-11(10-14-2)6-4-7-12-8-5-9-15-12/h11-13H,3-10H2,1-2H3
InChIKeyPFMGVHDLODQICZ-UHFFFAOYSA-N
XLogP1.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-methoxy-1-(oxolan-2-yl)pentan-2-amine
CID 62602456
N-ethyl-5-(oxolan-2-yl)-1-phenoxypentan-2-amine
CID 65164198
N-ethyl-1,1,1-trifluoro-6-(oxolan-2-yl)hexan-3-amine
CID 65164289
5-(oxolan-2-yl)-1-propoxy-N-propylpentan-2-amine
CID 65164347
N-ethyl-1-(oxolan-2-yl)heptan-3-amine
CID 79404378
N-ethyl-5-methoxy-1-(oxan-2-yl)pentan-2-amine
CID 114856946
N-ethyl-1-(4-fluorophenyl)-5-(oxolan-2-yl)pentan-2-amine
CID 65167136
6-(oxolan-2-yl)-1-propoxy-N-propylhexan-3-amine
CID 105156636
1-(2,2-difluoroethoxy)-6-(oxolan-2-yl)-N-propylhexan-3-amine
CID 103149889
N-ethyl-4-(oxolan-2-yl)-1-(2,2,3,3-tetrafluoropropoxy)butan-2-amine
CID 103475709
1-fluoro-3-methoxy-N-(oxolan-2-ylmethyl)propan-2-amine
CID 83818042
N-ethyl-1-methylsulfanyl-4-(oxolan-2-yl)butan-2-amine
CID 65164506

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine?
The IUPAC name of N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine (CID 65161819) is N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine.
What is the SMILES notation for N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine?
The canonical SMILES for N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine is CCNC(CCCC1CCCO1)COC.
What is the InChIKey of N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine?
The InChIKey is PFMGVHDLODQICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-3-13-11(10-14-2)6-4-7-12-8-5-9-15-12/h11-13H,3-10H2,1-2H3.
What are the key properties of N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine?
N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine has a molecular weight of 215.34 g/mol, XLogP of 1.96, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methoxy-5-(oxolan-2-yl)pentan-2-amine is sourced from PubChem (CID 65161819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).