2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol

C12H17NO — CID 65049994

IUPAC2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol
SMILESCc1ccc(C2(O)CCCC2C)cn1
InChIInChI=1S/C12H17NO/c1-9-4-3-7-12(9,14)11-6-5-10(2)13-8-11/h5-6,8-9,14H,3-4,7H2,1-2H3
InChIKeyLVPQYNIMJQYFHU-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.40
Rot. Bonds1

About 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol

2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol (PubChem CID 65049994) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol.

Molecular Properties

Compound Name2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol
PubChem CID65049994
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol
SMILESCc1ccc(C2(O)CCCC2C)cn1
InChIInChI=1S/C12H17NO/c1-9-4-3-7-12(9,14)11-6-5-10(2)13-8-11/h5-6,8-9,14H,3-4,7H2,1-2H3
InChIKeyLVPQYNIMJQYFHU-UHFFFAOYSA-N
XLogP2.40
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol?
The IUPAC name of 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol (CID 65049994) is 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol.
What is the SMILES notation for 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol?
The canonical SMILES for 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol is Cc1ccc(C2(O)CCCC2C)cn1.
What is the InChIKey of 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol?
The InChIKey is LVPQYNIMJQYFHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-9-4-3-7-12(9,14)11-6-5-10(2)13-8-11/h5-6,8-9,14H,3-4,7H2,1-2H3.
What are the key properties of 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol?
2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol has a molecular weight of 191.27 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(6-methyl-3-pyridinyl)cyclopentan-1-ol is sourced from PubChem (CID 65049994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).