prop-1-ene

C3H5+ — CID 23558401

IUPACprop-1-ene
SMILESC=[C+]C
InChIInChI=1S/C3H5/c1-3-2/h1H2,2H3/q+1
InChIKeyHTMKJAWNIZJNPX-UHFFFAOYSA-N
MW41.07 g/mol
LogP1.00
Rot. Bonds

About prop-1-ene

prop-1-ene (PubChem CID 23558401) has the molecular formula C3H5+ and a molecular weight of 41.07 g/mol. Its IUPAC name is prop-1-ene.

Molecular Properties

Compound Nameprop-1-ene
PubChem CID23558401
Molecular FormulaC3H5+
Molecular Weight41.07 g/mol
Exact Mass41.04
IUPAC Nameprop-1-ene
SMILESC=[C+]C
InChIInChI=1S/C3H5/c1-3-2/h1H2,2H3/q+1
InChIKeyHTMKJAWNIZJNPX-UHFFFAOYSA-N
XLogP1.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50041.07
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Lithium, (1-methylethenyl)-
CID 11789119
Copper(1+);prop-1-ene
CID 13833230
CID 18724448
CID 18724448
CID 102533116
CID 102533116
Potassium prop-1-en-2-ide
CID 21463904
Hydrido(prop-1-en-2-yl)mercury
CID 15298419
CID 178411445
CID 178411445
1-Methylethenyl
CID 12478066
Sodium prop-1-ene
CID 19973316
Prop-1-ene;tetrakis(yttrium)
CID 20709715
Prop-1-ene;uranium
CID 58683493
Prop-1-ene;tris(yttrium)
CID 58718767

Frequently Asked Questions

What is the IUPAC name of prop-1-ene?
The IUPAC name of prop-1-ene (CID 23558401) is prop-1-ene.
What is the SMILES notation for prop-1-ene?
The canonical SMILES for prop-1-ene is C=[C+]C.
What is the InChIKey of prop-1-ene?
The InChIKey is HTMKJAWNIZJNPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5/c1-3-2/h1H2,2H3/q+1.
What are the key properties of prop-1-ene?
prop-1-ene has a molecular weight of 41.07 g/mol, XLogP of 1.00, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for prop-1-ene is sourced from PubChem (CID 23558401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).