2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol

C13H20N2O — CID 102635956

IUPAC2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol
SMILESCc1cc(N(C)C2CCCCC2O)ccn1
InChIInChI=1S/C13H20N2O/c1-10-9-11(7-8-14-10)15(2)12-5-3-4-6-13(12)16/h7-9,12-13,16H,3-6H2,1-2H3
InChIKeySFLOJNPXZKQBKT-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.13
Rot. Bonds2

About 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol

2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol (PubChem CID 102635956) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol
PubChem CID102635956
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol
SMILESCc1cc(N(C)C2CCCCC2O)ccn1
InChIInChI=1S/C13H20N2O/c1-10-9-11(7-8-14-10)15(2)12-5-3-4-6-13(12)16/h7-9,12-13,16H,3-6H2,1-2H3
InChIKeySFLOJNPXZKQBKT-UHFFFAOYSA-N
XLogP2.13
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol?
The IUPAC name of 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol (CID 102635956) is 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol?
The canonical SMILES for 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol is Cc1cc(N(C)C2CCCCC2O)ccn1.
What is the InChIKey of 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol?
The InChIKey is SFLOJNPXZKQBKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-9-11(7-8-14-10)15(2)12-5-3-4-6-13(12)16/h7-9,12-13,16H,3-6H2,1-2H3.
What are the key properties of 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol?
2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol has a molecular weight of 220.32 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol is sourced from PubChem (CID 102635956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).