6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol

C15H24N2O — CID 82983854

IUPAC6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol
SMILESCN(Cc1ccc(O)cn1)C1CCC(C)(C)CC1
InChIInChI=1S/C15H24N2O/c1-15(2)8-6-13(7-9-15)17(3)11-12-4-5-14(18)10-16-12/h4-5,10,13,18H,6-9,11H2,1-3H3
InChIKeyBIZYGVCWKRSLIO-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.19
Rot. Bonds3

About 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol

6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol (PubChem CID 82983854) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol
PubChem CID82983854
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol
SMILESCN(Cc1ccc(O)cn1)C1CCC(C)(C)CC1
InChIInChI=1S/C15H24N2O/c1-15(2)8-6-13(7-9-15)17(3)11-12-4-5-14(18)10-16-12/h4-5,10,13,18H,6-9,11H2,1-3H3
InChIKeyBIZYGVCWKRSLIO-UHFFFAOYSA-N
XLogP3.19
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol?
The IUPAC name of 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol (CID 82983854) is 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol?
The canonical SMILES for 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol is CN(Cc1ccc(O)cn1)C1CCC(C)(C)CC1.
What is the InChIKey of 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol?
The InChIKey is BIZYGVCWKRSLIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-15(2)8-6-13(7-9-15)17(3)11-12-4-5-14(18)10-16-12/h4-5,10,13,18H,6-9,11H2,1-3H3.
What are the key properties of 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol?
6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol has a molecular weight of 248.37 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]pyridin-3-ol is sourced from PubChem (CID 82983854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).