CID 14041363

C6H13 — CID 14041363

IUPAC—
SMILESC[C](C)C(C)C
InChIInChI=1S/C6H13/c1-5(2)6(3)4/h5H,1-4H3
InChIKeyUHYDNELGDYZAEO-UHFFFAOYSA-N
MW85.17 g/mol
LogP2.26
Rot. Bonds1

About CID 14041363

CID 14041363 (PubChem CID 14041363) has the molecular formula C6H13 and a molecular weight of 85.17 g/mol.

Molecular Properties

Compound NameCID 14041363
PubChem CID14041363
Molecular FormulaC6H13
Molecular Weight85.17 g/mol
Exact Mass85.10
IUPAC Name—
SMILESC[C](C)C(C)C
InChIInChI=1S/C6H13/c1-5(2)6(3)4/h5H,1-4H3
InChIKeyUHYDNELGDYZAEO-UHFFFAOYSA-N
XLogP2.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50085.17
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 14041363?
The IUPAC name of CID 14041363 (CID 14041363) is not available.
What is the SMILES notation for CID 14041363?
The canonical SMILES for CID 14041363 is C[C](C)C(C)C.
What is the InChIKey of CID 14041363?
The InChIKey is UHYDNELGDYZAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13/c1-5(2)6(3)4/h5H,1-4H3.
What are the key properties of CID 14041363?
CID 14041363 has a molecular weight of 85.17 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 14041363 is sourced from PubChem (CID 14041363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).