N-ethyl-N-(tritiomethyl)ethanamine

C5H13N — CID 59085728

IUPACN-ethyl-N-(tritiomethyl)ethanamine
SMILES[3H]CN(CC)CC
InChIInChI=1S/C5H13N/c1-4-6(3)5-2/h4-5H2,1-3H3/i3T
InChIKeyGNVRJGIVDSQCOP-WJULDGBESA-N
MW89.17 g/mol
LogP0.96
Rot. Bonds3

About N-ethyl-N-(tritiomethyl)ethanamine

N-ethyl-N-(tritiomethyl)ethanamine (PubChem CID 59085728) has the molecular formula C5H13N and a molecular weight of 89.17 g/mol. Its IUPAC name is N-ethyl-N-(tritiomethyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-(tritiomethyl)ethanamine
PubChem CID59085728
Molecular FormulaC5H13N
Molecular Weight89.17 g/mol
Exact Mass89.11
IUPAC NameN-ethyl-N-(tritiomethyl)ethanamine
SMILES[3H]CN(CC)CC
InChIInChI=1S/C5H13N/c1-4-6(3)5-2/h4-5H2,1-3H3/i3T
InChIKeyGNVRJGIVDSQCOP-WJULDGBESA-N
XLogP0.96
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.17
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(tritiomethyl)ethanamine?
The IUPAC name of N-ethyl-N-(tritiomethyl)ethanamine (CID 59085728) is N-ethyl-N-(tritiomethyl)ethanamine.
What is the SMILES notation for N-ethyl-N-(tritiomethyl)ethanamine?
The canonical SMILES for N-ethyl-N-(tritiomethyl)ethanamine is [3H]CN(CC)CC.
What is the InChIKey of N-ethyl-N-(tritiomethyl)ethanamine?
The InChIKey is GNVRJGIVDSQCOP-WJULDGBESA-N. The full InChI is InChI=1S/C5H13N/c1-4-6(3)5-2/h4-5H2,1-3H3/i3T.
What are the key properties of N-ethyl-N-(tritiomethyl)ethanamine?
N-ethyl-N-(tritiomethyl)ethanamine has a molecular weight of 89.17 g/mol, XLogP of 0.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(tritiomethyl)ethanamine is sourced from PubChem (CID 59085728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).