CID 57436075

C10H13 — CID 57436075

IUPAC—
SMILES[CH2]Cc1ccc(CC)cc1
InChIInChI=1S/C10H13/c1-3-9-5-7-10(4-2)8-6-9/h5-8H,1,3-4H2,2H3
InChIKeyBJKZFTOKQQBQHB-UHFFFAOYSA-N
MW133.21 g/mol
LogP2.63
Rot. Bonds2

About CID 57436075

CID 57436075 (PubChem CID 57436075) has the molecular formula C10H13 and a molecular weight of 133.21 g/mol.

Molecular Properties

Compound NameCID 57436075
PubChem CID57436075
Molecular FormulaC10H13
Molecular Weight133.21 g/mol
Exact Mass133.10
IUPAC Name—
SMILES[CH2]Cc1ccc(CC)cc1
InChIInChI=1S/C10H13/c1-3-9-5-7-10(4-2)8-6-9/h5-8H,1,3-4H2,2H3
InChIKeyBJKZFTOKQQBQHB-UHFFFAOYSA-N
XLogP2.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.21
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 57436075?
The IUPAC name of CID 57436075 (CID 57436075) is not available.
What is the SMILES notation for CID 57436075?
The canonical SMILES for CID 57436075 is [CH2]Cc1ccc(CC)cc1.
What is the InChIKey of CID 57436075?
The InChIKey is BJKZFTOKQQBQHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13/c1-3-9-5-7-10(4-2)8-6-9/h5-8H,1,3-4H2,2H3.
What are the key properties of CID 57436075?
CID 57436075 has a molecular weight of 133.21 g/mol, XLogP of 2.63, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57436075 is sourced from PubChem (CID 57436075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).