1-(2-methyl-3-pyridinyl)cyclobutan-1-ol

C10H13NO — CID 89153359

IUPAC1-(2-methyl-3-pyridinyl)cyclobutan-1-ol
SMILESCc1ncccc1C1(O)CCC1
InChIInChI=1S/C10H13NO/c1-8-9(4-2-7-11-8)10(12)5-3-6-10/h2,4,7,12H,3,5-6H2,1H3
InChIKeyBYUWWUMDZUIAQD-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.76
Rot. Bonds1

About 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol

1-(2-methyl-3-pyridinyl)cyclobutan-1-ol (PubChem CID 89153359) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol.

Molecular Properties

Compound Name1-(2-methyl-3-pyridinyl)cyclobutan-1-ol
PubChem CID89153359
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name1-(2-methyl-3-pyridinyl)cyclobutan-1-ol
SMILESCc1ncccc1C1(O)CCC1
InChIInChI=1S/C10H13NO/c1-8-9(4-2-7-11-8)10(12)5-3-6-10/h2,4,7,12H,3,5-6H2,1H3
InChIKeyBYUWWUMDZUIAQD-UHFFFAOYSA-N
XLogP1.76
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol?
The IUPAC name of 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol (CID 89153359) is 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol.
What is the SMILES notation for 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol?
The canonical SMILES for 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol is Cc1ncccc1C1(O)CCC1.
What is the InChIKey of 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol?
The InChIKey is BYUWWUMDZUIAQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-8-9(4-2-7-11-8)10(12)5-3-6-10/h2,4,7,12H,3,5-6H2,1H3.
What are the key properties of 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol?
1-(2-methyl-3-pyridinyl)cyclobutan-1-ol has a molecular weight of 163.22 g/mol, XLogP of 1.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3-pyridinyl)cyclobutan-1-ol is sourced from PubChem (CID 89153359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).