N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine

C11H23NO2 — CID 63557232

IUPACN-ethyl-5-(oxolan-3-yloxy)pentan-2-amine
SMILESCCNC(C)CCCOC1CCOC1
InChIInChI=1S/C11H23NO2/c1-3-12-10(2)5-4-7-14-11-6-8-13-9-11/h10-12H,3-9H2,1-2H3
InChIKeyOTBCSJJAJNAGJT-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.57
Rot. Bonds7

About N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine

N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine (PubChem CID 63557232) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine.

Molecular Properties

Compound NameN-ethyl-5-(oxolan-3-yloxy)pentan-2-amine
PubChem CID63557232
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-ethyl-5-(oxolan-3-yloxy)pentan-2-amine
SMILESCCNC(C)CCCOC1CCOC1
InChIInChI=1S/C11H23NO2/c1-3-12-10(2)5-4-7-14-11-6-8-13-9-11/h10-12H,3-9H2,1-2H3
InChIKeyOTBCSJJAJNAGJT-UHFFFAOYSA-N
XLogP1.57
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.57
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

1-cyclopropyl-N-[3-(oxolan-3-yloxy)propyl]propan-2-amine
CID 115727743
2-(ethylamino)-4-(oxolan-3-yloxy)butanoic acid
CID 63558292
3-propoxyoxolane
CID 14071397
2-ethyl-N-[3-(oxolan-3-yloxy)propyl]butan-1-amine
CID 115757125
N-ethyl-3,3-dimethyl-1-(oxolan-3-yloxy)butan-2-amine
CID 63558838
3-[(3R)-oxolan-3-yl]oxypropan-1-amine
CID 95969618
(3R)-3-(3-bromopropoxy)oxolane
CID 95240996
N-methyl-1-(oxolan-3-yloxy)propan-2-amine
CID 63556835
2-ethyl-5-(oxolan-3-yloxy)-2-(propan-2-ylamino)pentanoic acid
CID 106807068
N-[1-(oxolan-3-yloxy)propan-2-yl]butan-2-amine
CID 115727519
2-amino-3-methyl-N-[3-(oxolan-3-yloxy)propyl]pentanamide
CID 119812727
2-amino-N-[3-(oxolan-3-yloxy)propyl]pentanamide;hydrochloride
CID 119340229

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine?
The IUPAC name of N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine (CID 63557232) is N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine.
What is the SMILES notation for N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine?
The canonical SMILES for N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine is CCNC(C)CCCOC1CCOC1.
What is the InChIKey of N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine?
The InChIKey is OTBCSJJAJNAGJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-3-12-10(2)5-4-7-14-11-6-8-13-9-11/h10-12H,3-9H2,1-2H3.
What are the key properties of N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine?
N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine has a molecular weight of 201.31 g/mol, XLogP of 1.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(oxolan-3-yloxy)pentan-2-amine is sourced from PubChem (CID 63557232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).