2-methylprop-1-ene

C4H8 — CID 8255

IUPAC2-methylprop-1-ene
SMILESC=C(C)C
InChIInChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3
InChIKeyVQTUBCCKSQIDNK-UHFFFAOYSA-N
MW56.11 g/mol
LogP1.58
Rot. Bonds

About 2-methylprop-1-ene

2-methylprop-1-ene (PubChem CID 8255) has the molecular formula C4H8 and a molecular weight of 56.11 g/mol. Its IUPAC name is 2-methylprop-1-ene.

Molecular Properties

Compound Name2-methylprop-1-ene
PubChem CID8255
Molecular FormulaC4H8
Molecular Weight56.11 g/mol
Exact Mass56.06
IUPAC Name2-methylprop-1-ene
SMILESC=C(C)C
InChIInChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3
InChIKeyVQTUBCCKSQIDNK-UHFFFAOYSA-N
XLogP1.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50056.11
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2-methylprop-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

Related Compounds

2-Methyl-2-butene
CID 10553
2-Methyl-1-butene
CID 11240
3-Methyl-1,2-butadiene
CID 11714
2,4-Dimethylpenta-2,3-diene
CID 66081
2,3-Pentadiene, 2-methyl-
CID 137807
Lithium, (2-methyl-1-propenyl)-
CID 11051565
Lithium, (2-methyl-2-propenyl)-
CID 11629588
Ethene;2-methylprop-1-ene
CID 91362200
Butane;2-methylprop-1-ene
CID 142050656
Zinc, bis(2-methyl-2-propenyl)-
CID 543218
CID 21627814
CID 21627814
CID 6455714
CID 6455714

Frequently Asked Questions

What is the IUPAC name of 2-methylprop-1-ene?
The IUPAC name of 2-methylprop-1-ene (CID 8255) is 2-methylprop-1-ene.
What is the SMILES notation for 2-methylprop-1-ene?
The canonical SMILES for 2-methylprop-1-ene is C=C(C)C.
What is the InChIKey of 2-methylprop-1-ene?
The InChIKey is VQTUBCCKSQIDNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3.
What are the key properties of 2-methylprop-1-ene?
2-methylprop-1-ene has a molecular weight of 56.11 g/mol, XLogP of 1.58, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylprop-1-ene is sourced from PubChem (CID 8255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).