N-ethenyl-N-ethylethanamine

C6H13N — CID 12773283

IUPACN-ethenyl-N-ethylethanamine
SMILESC=CN(CC)CC
InChIInChI=1S/C6H13N/c1-4-7(5-2)6-3/h4H,1,5-6H2,2-3H3
InChIKeyIQFXJRXOTKFGPN-UHFFFAOYSA-N
MW99.18 g/mol
LogP1.47
Rot. Bonds3

About N-ethenyl-N-ethylethanamine

N-ethenyl-N-ethylethanamine (PubChem CID 12773283) has the molecular formula C6H13N and a molecular weight of 99.18 g/mol. Its IUPAC name is N-ethenyl-N-ethylethanamine.

Molecular Properties

Compound NameN-ethenyl-N-ethylethanamine
PubChem CID12773283
Molecular FormulaC6H13N
Molecular Weight99.18 g/mol
Exact Mass99.10
IUPAC NameN-ethenyl-N-ethylethanamine
SMILESC=CN(CC)CC
InChIInChI=1S/C6H13N/c1-4-7(5-2)6-3/h4H,1,5-6H2,2-3H3
InChIKeyIQFXJRXOTKFGPN-UHFFFAOYSA-N
XLogP1.47
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.18
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-ethylethanamine?
The IUPAC name of N-ethenyl-N-ethylethanamine (CID 12773283) is N-ethenyl-N-ethylethanamine.
What is the SMILES notation for N-ethenyl-N-ethylethanamine?
The canonical SMILES for N-ethenyl-N-ethylethanamine is C=CN(CC)CC.
What is the InChIKey of N-ethenyl-N-ethylethanamine?
The InChIKey is IQFXJRXOTKFGPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N/c1-4-7(5-2)6-3/h4H,1,5-6H2,2-3H3.
What are the key properties of N-ethenyl-N-ethylethanamine?
N-ethenyl-N-ethylethanamine has a molecular weight of 99.18 g/mol, XLogP of 1.47, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N-ethylethanamine is sourced from PubChem (CID 12773283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).