CID 59448637

C6H10 — CID 59448637

IUPAC—
SMILES[CH]C/C(C)=C/C
InChIInChI=1S/C6H10/c1-4-6(3)5-2/h1,5H,4H2,2-3H3/b6-5+
InChIKeyOMQMMAIIXJXKHR-AATRIKPKSA-N
MW82.15 g/mol
LogP2.05
Rot. Bonds1

About CID 59448637

CID 59448637 (PubChem CID 59448637) has the molecular formula C6H10 and a molecular weight of 82.15 g/mol.

Molecular Properties

Compound NameCID 59448637
PubChem CID59448637
Molecular FormulaC6H10
Molecular Weight82.15 g/mol
Exact Mass82.08
IUPAC Name—
SMILES[CH]C/C(C)=C/C
InChIInChI=1S/C6H10/c1-4-6(3)5-2/h1,5H,4H2,2-3H3/b6-5+
InChIKeyOMQMMAIIXJXKHR-AATRIKPKSA-N
XLogP2.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50082.15
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 59448637?
The IUPAC name of CID 59448637 (CID 59448637) is not available.
What is the SMILES notation for CID 59448637?
The canonical SMILES for CID 59448637 is [CH]C/C(C)=C/C.
What is the InChIKey of CID 59448637?
The InChIKey is OMQMMAIIXJXKHR-AATRIKPKSA-N. The full InChI is InChI=1S/C6H10/c1-4-6(3)5-2/h1,5H,4H2,2-3H3/b6-5+.
What are the key properties of CID 59448637?
CID 59448637 has a molecular weight of 82.15 g/mol, XLogP of 2.05, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59448637 is sourced from PubChem (CID 59448637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).