N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium

C8H16LrNO- — CID 22896089

IUPACN-ethyl-2,4-dimethyloxolan-3-amine;lawrencium
SMILESC[CH-]NC1C(C)COC1C.[Lr]
InChIInChI=1S/C8H16NO.Lr/c1-4-9-8-6(2)5-10-7(8)3;/h4,6-9H,5H2,1-3H3;/q-1;
InChIKeyAVFUNAADQAHRKR-UHFFFAOYSA-N
MW404.22 g/mol
LogP1.18
Rot. Bonds2

About N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium

N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium (PubChem CID 22896089) has the molecular formula C8H16LrNO- and a molecular weight of 404.22 g/mol. Its IUPAC name is N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium.

Molecular Properties

Compound NameN-ethyl-2,4-dimethyloxolan-3-amine;lawrencium
PubChem CID22896089
Molecular FormulaC8H16LrNO-
Molecular Weight404.22 g/mol
Exact Mass404.23
IUPAC NameN-ethyl-2,4-dimethyloxolan-3-amine;lawrencium
SMILESC[CH-]NC1C(C)COC1C.[Lr]
InChIInChI=1S/C8H16NO.Lr/c1-4-9-8-6(2)5-10-7(8)3;/h4,6-9H,5H2,1-3H3;/q-1;
InChIKeyAVFUNAADQAHRKR-UHFFFAOYSA-N
XLogP1.18
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.22
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Oxazolidine, 4-ethyl-2-methyl-2-(3-methylbutyl)-
CID 5105001
4-Ethyl-2-methyl-2-(2-methylpropyl)-1,3-oxazolidine
CID 19920832
(4S)-4-[(2R)-butan-2-yl]-2,2-dimethyl-1,3-oxazolidine
CID 91064599
(3R)-3-(3-methylbutoxy)pyrrolidine
CID 26191825
N-(3-fluoropropyl)-2-methyloxolan-3-amine
CID 82724932
1-fluoro-3-methyl-N-(oxolan-2-ylmethyl)butan-2-amine
CID 83817897
(2S,4S)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995025
(2R,4S)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995028
(2S,4R)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995031
(2R,4R)-4-(2-fluoroethoxy)-2-propan-2-ylpyrrolidine
CID 99995033
4-(2-Fluoro-ethoxy)-2-isopropyl-pyrrolidine
CID 102568647
N-(2-fluoroethyl)-2,3-dimethyloxolan-3-amine
CID 103581302

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium?
The IUPAC name of N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium (CID 22896089) is N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium.
What is the SMILES notation for N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium?
The canonical SMILES for N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium is C[CH-]NC1C(C)COC1C.[Lr].
What is the InChIKey of N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium?
The InChIKey is AVFUNAADQAHRKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16NO.Lr/c1-4-9-8-6(2)5-10-7(8)3;/h4,6-9H,5H2,1-3H3;/q-1;.
What are the key properties of N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium?
N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium has a molecular weight of 404.22 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4-dimethyloxolan-3-amine;lawrencium is sourced from PubChem (CID 22896089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).