1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol

C15H23NO2 — CID 65142759

IUPAC1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol
SMILESCOc1c(C)cnc(CC2(O)CCCCC2)c1C
InChIInChI=1S/C15H23NO2/c1-11-10-16-13(12(2)14(11)18-3)9-15(17)7-5-4-6-8-15/h10,17H,4-9H2,1-3H3
InChIKeyUACXVBWLPVUBCV-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.94
Rot. Bonds3

About 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol

1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol (PubChem CID 65142759) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol
PubChem CID65142759
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol
SMILESCOc1c(C)cnc(CC2(O)CCCCC2)c1C
InChIInChI=1S/C15H23NO2/c1-11-10-16-13(12(2)14(11)18-3)9-15(17)7-5-4-6-8-15/h10,17H,4-9H2,1-3H3
InChIKeyUACXVBWLPVUBCV-UHFFFAOYSA-N
XLogP2.94
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-1,1-dioxothiolan-3-ol
CID 65145771
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexane-1-carbonitrile
CID 65376799
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-propan-2-ylcyclobutan-1-ol
CID 103564266
1-[1-hydroxy-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]cyclopentan-1-ol
CID 103448486
1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentyl]-N-methylmethanamine
CID 62724590
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopropane-1-carboxylic acid
CID 66024192
N-[[1-(chloromethyl)cyclohexyl]methyl]-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)methanamine
CID 103969062
1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclobutyl]-N-methylmethanamine
CID 65194645
3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2,2,5,5-tetramethyloxolan-3-ol
CID 79913158
[3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]methanol
CID 66058388
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2,3,5,6,7,8-hexahydropyrrolizin-1-ol
CID 82855728
1-(aminomethyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylcyclohexan-1-amine
CID 62006915

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol?
The IUPAC name of 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol (CID 65142759) is 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol is COc1c(C)cnc(CC2(O)CCCCC2)c1C.
What is the InChIKey of 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol?
The InChIKey is UACXVBWLPVUBCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11-10-16-13(12(2)14(11)18-3)9-15(17)7-5-4-6-8-15/h10,17H,4-9H2,1-3H3.
What are the key properties of 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol?
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol has a molecular weight of 249.35 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 65142759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).