2-methylpentan-2-ol

C6H14O — CID 11543

IUPAC2-methylpentan-2-ol
SMILESCCCC(C)(C)O
InChIInChI=1S/C6H14O/c1-4-5-6(2,3)7/h7H,4-5H2,1-3H3
InChIKeyWFRBDWRZVBPBDO-UHFFFAOYSA-N
MW102.18 g/mol
LogP1.56
Rot. Bonds2

About 2-methylpentan-2-ol

2-methylpentan-2-ol (PubChem CID 11543) has the molecular formula C6H14O and a molecular weight of 102.18 g/mol. Its IUPAC name is 2-methylpentan-2-ol.

Molecular Properties

Compound Name2-methylpentan-2-ol
PubChem CID11543
Molecular FormulaC6H14O
Molecular Weight102.18 g/mol
Exact Mass102.10
IUPAC Name2-methylpentan-2-ol
SMILESCCCC(C)(C)O
InChIInChI=1S/C6H14O/c1-4-5-6(2,3)7/h7H,4-5H2,1-3H3
InChIKeyWFRBDWRZVBPBDO-UHFFFAOYSA-N
XLogP1.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.18
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methylpentan-2-ol?
The IUPAC name of 2-methylpentan-2-ol (CID 11543) is 2-methylpentan-2-ol.
What is the SMILES notation for 2-methylpentan-2-ol?
The canonical SMILES for 2-methylpentan-2-ol is CCCC(C)(C)O.
What is the InChIKey of 2-methylpentan-2-ol?
The InChIKey is WFRBDWRZVBPBDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O/c1-4-5-6(2,3)7/h7H,4-5H2,1-3H3.
What are the key properties of 2-methylpentan-2-ol?
2-methylpentan-2-ol has a molecular weight of 102.18 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpentan-2-ol is sourced from PubChem (CID 11543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).