CID 101155175

C6H9 — CID 101155175

IUPAC—
SMILES[CH2][C@H]1CC12CC2
InChIInChI=1S/C6H9/c1-5-4-6(5)2-3-6/h5H,1-4H2/t5-/m0/s1
InChIKeyNUBXZPZDNFGXEC-YFKPBYRVSA-N
MW81.14 g/mol
LogP1.62
Rot. Bonds

About CID 101155175

CID 101155175 (PubChem CID 101155175) has the molecular formula C6H9 and a molecular weight of 81.14 g/mol.

Molecular Properties

Compound NameCID 101155175
PubChem CID101155175
Molecular FormulaC6H9
Molecular Weight81.14 g/mol
Exact Mass81.07
IUPAC Name—
SMILES[CH2][C@H]1CC12CC2
InChIInChI=1S/C6H9/c1-5-4-6(5)2-3-6/h5H,1-4H2/t5-/m0/s1
InChIKeyNUBXZPZDNFGXEC-YFKPBYRVSA-N
XLogP1.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50081.14
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 101155175?
The IUPAC name of CID 101155175 (CID 101155175) is not available.
What is the SMILES notation for CID 101155175?
The canonical SMILES for CID 101155175 is [CH2][C@H]1CC12CC2.
What is the InChIKey of CID 101155175?
The InChIKey is NUBXZPZDNFGXEC-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H9/c1-5-4-6(5)2-3-6/h5H,1-4H2/t5-/m0/s1.
What are the key properties of CID 101155175?
CID 101155175 has a molecular weight of 81.14 g/mol, XLogP of 1.62, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 101155175 is sourced from PubChem (CID 101155175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).