N-ethenylpropa-1,2-dien-1-amine

C5H7N — CID 176545935

IUPACN-ethenylpropa-1,2-dien-1-amine
SMILESC=C=CNC=C
InChIInChI=1S/C5H7N/c1-3-5-6-4-2/h4-6H,1-2H2
InChIKeyQKQAVYFWXKOHJD-UHFFFAOYSA-N
MW81.12 g/mol
LogP1.02
Rot. Bonds2

About N-ethenylpropa-1,2-dien-1-amine

N-ethenylpropa-1,2-dien-1-amine (PubChem CID 176545935) has the molecular formula C5H7N and a molecular weight of 81.12 g/mol. Its IUPAC name is N-ethenylpropa-1,2-dien-1-amine.

Molecular Properties

Compound NameN-ethenylpropa-1,2-dien-1-amine
PubChem CID176545935
Molecular FormulaC5H7N
Molecular Weight81.12 g/mol
Exact Mass81.06
IUPAC NameN-ethenylpropa-1,2-dien-1-amine
SMILESC=C=CNC=C
InChIInChI=1S/C5H7N/c1-3-5-6-4-2/h4-6H,1-2H2
InChIKeyQKQAVYFWXKOHJD-UHFFFAOYSA-N
XLogP1.02
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50081.12
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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1H-pyridine
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Frequently Asked Questions

What is the IUPAC name of N-ethenylpropa-1,2-dien-1-amine?
The IUPAC name of N-ethenylpropa-1,2-dien-1-amine (CID 176545935) is N-ethenylpropa-1,2-dien-1-amine.
What is the SMILES notation for N-ethenylpropa-1,2-dien-1-amine?
The canonical SMILES for N-ethenylpropa-1,2-dien-1-amine is C=C=CNC=C.
What is the InChIKey of N-ethenylpropa-1,2-dien-1-amine?
The InChIKey is QKQAVYFWXKOHJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N/c1-3-5-6-4-2/h4-6H,1-2H2.
What are the key properties of N-ethenylpropa-1,2-dien-1-amine?
N-ethenylpropa-1,2-dien-1-amine has a molecular weight of 81.12 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenylpropa-1,2-dien-1-amine is sourced from PubChem (CID 176545935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).