2-hexyl-1-methylcyclopropan-1-ol

C10H20O — CID 11194459

IUPAC2-hexyl-1-methylcyclopropan-1-ol
SMILESCCCCCCC1CC1(C)O
InChIInChI=1S/C10H20O/c1-3-4-5-6-7-9-8-10(9,2)11/h9,11H,3-8H2,1-2H3
InChIKeyTZJWYJMGLGYJQO-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.73
Rot. Bonds5

About 2-hexyl-1-methylcyclopropan-1-ol

2-hexyl-1-methylcyclopropan-1-ol (PubChem CID 11194459) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-hexyl-1-methylcyclopropan-1-ol.

Molecular Properties

Compound Name2-hexyl-1-methylcyclopropan-1-ol
PubChem CID11194459
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name2-hexyl-1-methylcyclopropan-1-ol
SMILESCCCCCCC1CC1(C)O
InChIInChI=1S/C10H20O/c1-3-4-5-6-7-9-8-10(9,2)11/h9,11H,3-8H2,1-2H3
InChIKeyTZJWYJMGLGYJQO-UHFFFAOYSA-N
XLogP2.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hexyl-1-methylcyclopropan-1-ol?
The IUPAC name of 2-hexyl-1-methylcyclopropan-1-ol (CID 11194459) is 2-hexyl-1-methylcyclopropan-1-ol.
What is the SMILES notation for 2-hexyl-1-methylcyclopropan-1-ol?
The canonical SMILES for 2-hexyl-1-methylcyclopropan-1-ol is CCCCCCC1CC1(C)O.
What is the InChIKey of 2-hexyl-1-methylcyclopropan-1-ol?
The InChIKey is TZJWYJMGLGYJQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-3-4-5-6-7-9-8-10(9,2)11/h9,11H,3-8H2,1-2H3.
What are the key properties of 2-hexyl-1-methylcyclopropan-1-ol?
2-hexyl-1-methylcyclopropan-1-ol has a molecular weight of 156.27 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hexyl-1-methylcyclopropan-1-ol is sourced from PubChem (CID 11194459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).