N-ethylprop-1-en-1-amine;hydrochloride

C5H12ClN — CID 155653050

IUPACN-ethylprop-1-en-1-amine;hydrochloride
SMILESCC=CNCC.Cl
InChIInChI=1S/C5H11N.ClH/c1-3-5-6-4-2;/h3,5-6H,4H2,1-2H3;1H
InChIKeyAVMXUNYMAQVUJH-UHFFFAOYSA-N
MW121.61 g/mol
LogP1.55
Rot. Bonds2

About N-ethylprop-1-en-1-amine;hydrochloride

N-ethylprop-1-en-1-amine;hydrochloride (PubChem CID 155653050) has the molecular formula C5H12ClN and a molecular weight of 121.61 g/mol. Its IUPAC name is N-ethylprop-1-en-1-amine;hydrochloride.

Molecular Properties

Compound NameN-ethylprop-1-en-1-amine;hydrochloride
PubChem CID155653050
Molecular FormulaC5H12ClN
Molecular Weight121.61 g/mol
Exact Mass121.07
IUPAC NameN-ethylprop-1-en-1-amine;hydrochloride
SMILESCC=CNCC.Cl
InChIInChI=1S/C5H11N.ClH/c1-3-5-6-4-2;/h3,5-6H,4H2,1-2H3;1H
InChIKeyAVMXUNYMAQVUJH-UHFFFAOYSA-N
XLogP1.55
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.61
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethylprop-1-en-1-amine;hydrochloride?
The IUPAC name of N-ethylprop-1-en-1-amine;hydrochloride (CID 155653050) is N-ethylprop-1-en-1-amine;hydrochloride.
What is the SMILES notation for N-ethylprop-1-en-1-amine;hydrochloride?
The canonical SMILES for N-ethylprop-1-en-1-amine;hydrochloride is CC=CNCC.Cl.
What is the InChIKey of N-ethylprop-1-en-1-amine;hydrochloride?
The InChIKey is AVMXUNYMAQVUJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.ClH/c1-3-5-6-4-2;/h3,5-6H,4H2,1-2H3;1H.
What are the key properties of N-ethylprop-1-en-1-amine;hydrochloride?
N-ethylprop-1-en-1-amine;hydrochloride has a molecular weight of 121.61 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylprop-1-en-1-amine;hydrochloride is sourced from PubChem (CID 155653050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).