N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen

C8H19NO — CID 143246350

IUPACN-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen
SMILESCCNC1COC(C)(C)C1.[H][H]
InChIInChI=1S/C8H17NO.H2/c1-4-9-7-5-8(2,3)10-6-7;/h7,9H,4-6H2,1-3H3;1H
InChIKeyLODHCKABAFABKK-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.41
Rot. Bonds2

About N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen

N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen (PubChem CID 143246350) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen.

Molecular Properties

Compound NameN-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen
PubChem CID143246350
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC NameN-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen
SMILESCCNC1COC(C)(C)C1.[H][H]
InChIInChI=1S/C8H17NO.H2/c1-4-9-7-5-8(2,3)10-6-7;/h7,9H,4-6H2,1-3H3;1H
InChIKeyLODHCKABAFABKK-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
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-5,5-dimethyloxolan-3-amine;molecular hydrogen?
The IUPAC name of N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen (CID 143246350) is N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen.
What is the SMILES notation for N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen?
The canonical SMILES for N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen is CCNC1COC(C)(C)C1.[H][H].
What is the InChIKey of N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen?
The InChIKey is LODHCKABAFABKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.H2/c1-4-9-7-5-8(2,3)10-6-7;/h7,9H,4-6H2,1-3H3;1H.
What are the key properties of N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen?
N-ethyl-5,5-dimethyloxolan-3-amine;molecular hydrogen has a molecular weight of 145.25 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-5,5-dimethyloxolan-3-amine;molecular hydrogen is sourced from PubChem (CID 143246350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).