N-ethyl-2,4,5-trimethyloxolan-3-amine

C9H19NO — CID 18339632

IUPACN-ethyl-2,4,5-trimethyloxolan-3-amine
SMILESCCNC1C(C)OC(C)C1C
InChIInChI=1S/C9H19NO/c1-5-10-9-6(2)7(3)11-8(9)4/h6-10H,5H2,1-4H3
InChIKeyAOHVVAIDNQGYDC-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.41
Rot. Bonds2

About N-ethyl-2,4,5-trimethyloxolan-3-amine

N-ethyl-2,4,5-trimethyloxolan-3-amine (PubChem CID 18339632) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-ethyl-2,4,5-trimethyloxolan-3-amine.

Molecular Properties

Compound NameN-ethyl-2,4,5-trimethyloxolan-3-amine
PubChem CID18339632
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-ethyl-2,4,5-trimethyloxolan-3-amine
SMILESCCNC1C(C)OC(C)C1C
InChIInChI=1S/C9H19NO/c1-5-10-9-6(2)7(3)11-8(9)4/h6-10H,5H2,1-4H3
InChIKeyAOHVVAIDNQGYDC-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4,5-trimethyloxolan-3-amine?
The IUPAC name of N-ethyl-2,4,5-trimethyloxolan-3-amine (CID 18339632) is N-ethyl-2,4,5-trimethyloxolan-3-amine.
What is the SMILES notation for N-ethyl-2,4,5-trimethyloxolan-3-amine?
The canonical SMILES for N-ethyl-2,4,5-trimethyloxolan-3-amine is CCNC1C(C)OC(C)C1C.
What is the InChIKey of N-ethyl-2,4,5-trimethyloxolan-3-amine?
The InChIKey is AOHVVAIDNQGYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-5-10-9-6(2)7(3)11-8(9)4/h6-10H,5H2,1-4H3.
What are the key properties of N-ethyl-2,4,5-trimethyloxolan-3-amine?
N-ethyl-2,4,5-trimethyloxolan-3-amine has a molecular weight of 157.26 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4,5-trimethyloxolan-3-amine is sourced from PubChem (CID 18339632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).