prop-2-en-1-amine

C3H7N — CID 7853

IUPACprop-2-en-1-amine
SMILESC=CCN
InChIInChI=1S/C3H7N/c1-2-3-4/h2H,1,3-4H2
InChIKeyVVJKKWFAADXIJK-UHFFFAOYSA-N
MW57.10 g/mol
LogP0.13
Rot. Bonds1

About prop-2-en-1-amine

prop-2-en-1-amine (PubChem CID 7853) has the molecular formula C3H7N and a molecular weight of 57.10 g/mol. Its IUPAC name is prop-2-en-1-amine.

Molecular Properties

Compound Nameprop-2-en-1-amine
PubChem CID7853
Molecular FormulaC3H7N
Molecular Weight57.10 g/mol
Exact Mass57.06
IUPAC Nameprop-2-en-1-amine
SMILESC=CCN
InChIInChI=1S/C3H7N/c1-2-3-4/h2H,1,3-4H2
InChIKeyVVJKKWFAADXIJK-UHFFFAOYSA-N
XLogP0.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50057.10
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Allylamine hydrochloride
CID 82291
Buta-2,3-dien-1-amine
CID 10329243
(~13~C_3_)Prop-2-en-1-(~15~N)amine
CID 71309404
(e)-3-Fluoroallylamine
CID 19800330
Fluoro-2-propen-1-amine
CID 21915321
Fluoroallylamine
CID 23199519
Prop-2-enylazanium
CID 5153084
Prop-2-enylazanium chloride
CID 11083829
Hydron;prop-2-en-1-amine;chloride
CID 92017980
(~13~C_3_)Prop-2-en-1-(~15~N)amine--hydrogen chloride (1/1)
CID 71309403
Lithium prop-2-enylazanide
CID 11366947
N-chloroprop-2-en-1-amine
CID 12815214

Frequently Asked Questions

What is the IUPAC name of prop-2-en-1-amine?
The IUPAC name of prop-2-en-1-amine (CID 7853) is prop-2-en-1-amine.
What is the SMILES notation for prop-2-en-1-amine?
The canonical SMILES for prop-2-en-1-amine is C=CCN.
What is the InChIKey of prop-2-en-1-amine?
The InChIKey is VVJKKWFAADXIJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N/c1-2-3-4/h2H,1,3-4H2.
What are the key properties of prop-2-en-1-amine?
prop-2-en-1-amine has a molecular weight of 57.10 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-en-1-amine is sourced from PubChem (CID 7853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).