CID 153294147

C6H8 — CID 153294147

IUPAC—
SMILES[CH]C/C=C/C[CH]
InChIInChI=1S/C6H8/c1-3-5-6-4-2/h1-2,5-6H,3-4H2/b6-5+
InChIKeyGIRBSVAKHLQWJH-AATRIKPKSA-N
MW80.13 g/mol
LogP1.74
Rot. Bonds2

About CID 153294147

CID 153294147 (PubChem CID 153294147) has the molecular formula C6H8 and a molecular weight of 80.13 g/mol.

Molecular Properties

Compound NameCID 153294147
PubChem CID153294147
Molecular FormulaC6H8
Molecular Weight80.13 g/mol
Exact Mass80.06
IUPAC Name—
SMILES[CH]C/C=C/C[CH]
InChIInChI=1S/C6H8/c1-3-5-6-4-2/h1-2,5-6H,3-4H2/b6-5+
InChIKeyGIRBSVAKHLQWJH-AATRIKPKSA-N
XLogP1.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50080.13
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 153294147 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

hex-3-ene;sulfane
CID 174453265
hex-3-ene;hydrochloride
CID 159012047
(E)-hex-3-en-1-yne
CID 5367402
(5E)-octa-3,5-diene
CID 173104147
(Z)-hex-3-ene;methylazanium
CID 158917607
magnesium;(Z)-hex-3-ene;dibromide
CID 175085917
but-1-enyl-chloro-iodosilane
CID 151203746
pentadeca-3,6,9,12-tetraene
CID 123748490
(3Z,7Z,11Z)-tetradeca-3,7,11-triene
CID 123167975
(7Z)-deca-3,7-diene
CID 173009236
ethane;(3Z,5Z)-octa-3,5-diene
CID 142104932
but-1-enyl(diethoxy)silane
CID 154084935

Frequently Asked Questions

What is the IUPAC name of CID 153294147?
The IUPAC name of CID 153294147 (CID 153294147) is not available.
What is the SMILES notation for CID 153294147?
The canonical SMILES for CID 153294147 is [CH]C/C=C/C[CH].
What is the InChIKey of CID 153294147?
The InChIKey is GIRBSVAKHLQWJH-AATRIKPKSA-N. The full InChI is InChI=1S/C6H8/c1-3-5-6-4-2/h1-2,5-6H,3-4H2/b6-5+.
What are the key properties of CID 153294147?
CID 153294147 has a molecular weight of 80.13 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 153294147 is sourced from PubChem (CID 153294147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).