molecular hydrogen;prop-1-ene

C3H8 — CID 141044345

IUPACmolecular hydrogen;prop-1-ene
SMILESC=CC.[H][H]
InChIInChI=1S/C3H6.H2/c1-3-2;/h3H,1H2,2H3;1H
InChIKeyGLDOUSMUILYLFC-UHFFFAOYSA-N
MW44.10 g/mol
LogP1.44
Rot. Bonds

About molecular hydrogen;prop-1-ene

molecular hydrogen;prop-1-ene (PubChem CID 141044345) has the molecular formula C3H8 and a molecular weight of 44.10 g/mol. Its IUPAC name is molecular hydrogen;prop-1-ene.

Molecular Properties

Compound Namemolecular hydrogen;prop-1-ene
PubChem CID141044345
Molecular FormulaC3H8
Molecular Weight44.10 g/mol
Exact Mass44.06
IUPAC Namemolecular hydrogen;prop-1-ene
SMILESC=CC.[H][H]
InChIInChI=1S/C3H6.H2/c1-3-2;/h3H,1H2,2H3;1H
InChIKeyGLDOUSMUILYLFC-UHFFFAOYSA-N
XLogP1.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50044.10
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze molecular hydrogen;prop-1-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;prop-1-ene?
The IUPAC name of molecular hydrogen;prop-1-ene (CID 141044345) is molecular hydrogen;prop-1-ene.
What is the SMILES notation for molecular hydrogen;prop-1-ene?
The canonical SMILES for molecular hydrogen;prop-1-ene is C=CC.[H][H].
What is the InChIKey of molecular hydrogen;prop-1-ene?
The InChIKey is GLDOUSMUILYLFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6.H2/c1-3-2;/h3H,1H2,2H3;1H.
What are the key properties of molecular hydrogen;prop-1-ene?
molecular hydrogen;prop-1-ene has a molecular weight of 44.10 g/mol, XLogP of 1.44, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;prop-1-ene is sourced from PubChem (CID 141044345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).