CID 59805454

C10H14 — CID 59805454

IUPAC—
SMILES[CH]C(=C)C1CCCC(=C)C1
InChIInChI=1S/C10H14/c1-8(2)10-6-4-5-9(3)7-10/h1,10H,2-7H2
InChIKeyRWIFCQPWFJNANB-UHFFFAOYSA-N
MW134.22 g/mol
LogP3.00
Rot. Bonds1

About CID 59805454

CID 59805454 (PubChem CID 59805454) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol.

Molecular Properties

Compound NameCID 59805454
PubChem CID59805454
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Name—
SMILES[CH]C(=C)C1CCCC(=C)C1
InChIInChI=1S/C10H14/c1-8(2)10-6-4-5-9(3)7-10/h1,10H,2-7H2
InChIKeyRWIFCQPWFJNANB-UHFFFAOYSA-N
XLogP3.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 53.00
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 59805454?
The IUPAC name of CID 59805454 (CID 59805454) is not available.
What is the SMILES notation for CID 59805454?
The canonical SMILES for CID 59805454 is [CH]C(=C)C1CCCC(=C)C1.
What is the InChIKey of CID 59805454?
The InChIKey is RWIFCQPWFJNANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14/c1-8(2)10-6-4-5-9(3)7-10/h1,10H,2-7H2.
What are the key properties of CID 59805454?
CID 59805454 has a molecular weight of 134.22 g/mol, XLogP of 3.00, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59805454 is sourced from PubChem (CID 59805454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).