(4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol

C₁₄H₂₁NO — CID 106756225

About (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol

(4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol (PubChem CID 106756225) has the molecular formula C₁₄H₂₁NO and a molecular weight of 219.33 g/mol. Its IUPAC name is (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol.

Molecular Properties

• Compound Name: (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol
• PubChem CID: 106756225
• Molecular Formula: C₁₄H₂₁NO
• Molecular Weight: 219.33 g/mol
• Exact Mass: 219.16
• IUPAC Name: (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol
• SMILES: Cc1cc(C(O)C2CCC(C)CC2)ccn1
• InChI: InChI=1S/C14H21NO/c1-10-3-5-12(6-4-10)14(16)13-7-8-15-11(2)9-13/h7-10,12,14,16H,3-6H2,1-2H3
• InChIKey: FRARGFSNRKNIAZ-UHFFFAOYSA-N
• XLogP: 3.25
• TPSA: 33.12 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 2
• Heavy Atoms: 16
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	219.33
LogP ≤ 5	3.25
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol?

The IUPAC name of (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol (CID 106756225) is (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol.

What is the SMILES notation for (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol?

The canonical SMILES for (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol is Cc1cc(C(O)C2CCC(C)CC2)ccn1.

What is the InChIKey of (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol?

The InChIKey is FRARGFSNRKNIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10-3-5-12(6-4-10)14(16)13-7-8-15-11(2)9-13/h7-10,12,14,16H,3-6H2,1-2H3.

What are the key properties of (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol?

(4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol has a molecular weight of 219.33 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for (4-methylcyclohexyl)-(2-methyl-4-pyridinyl)methanol is sourced from PubChem (CID 106756225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 106756225 — identifiers, structure, computed properties (public domain)

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