(3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol

C15H23NO2 — CID 105102871

IUPAC(3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol
SMILESCOc1ncccc1C(O)C1CC(C)CC(C)C1
InChIInChI=1S/C15H23NO2/c1-10-7-11(2)9-12(8-10)14(17)13-5-4-6-16-15(13)18-3/h4-6,10-12,14,17H,7-9H2,1-3H3
InChIKeyYSNODKACKSZSFX-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.20
Rot. Bonds3

About (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol

(3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol (PubChem CID 105102871) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol.

Molecular Properties

Compound Name(3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol
PubChem CID105102871
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name(3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol
SMILESCOc1ncccc1C(O)C1CC(C)CC(C)C1
InChIInChI=1S/C15H23NO2/c1-10-7-11(2)9-12(8-10)14(17)13-5-4-6-16-15(13)18-3/h4-6,10-12,14,17H,7-9H2,1-3H3
InChIKeyYSNODKACKSZSFX-UHFFFAOYSA-N
XLogP3.20
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 ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;2-methoxy-3-propan-2-ylpyridine
CID 155741549
2-cyclobutyl-1-(2-methoxy-3-pyridinyl)ethanol
CID 105100853
1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol
CID 55292838
1-(2-methoxy-3-pyridinyl)-3-methylbut-2-en-1-ol
CID 105110251
2,3-dihydroxy-3-(2-methoxy-3-pyridinyl)propanoic acid
CID 170823762
2-cyclopropyl-1-(2-methoxy-3-pyridinyl)ethanamine
CID 55297501
2-methoxy-3-[(2R)-3-methylbutan-2-yl]pyridine
CID 176962095
(4-methoxyphenyl)-(2-methoxy-3-pyridinyl)methanol
CID 22934973
1-cycloheptyl-1-(2-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105176373
3,4-dihydro-2H-pyran-5-yl-(2-methoxy-3-pyridinyl)methanol
CID 105124451
(3,5-dimethylcyclohexyl)-phenylmethanol
CID 64730076
(1R)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine
CID 55276659

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol?
The IUPAC name of (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol (CID 105102871) is (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol.
What is the SMILES notation for (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol?
The canonical SMILES for (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol is COc1ncccc1C(O)C1CC(C)CC(C)C1.
What is the InChIKey of (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol?
The InChIKey is YSNODKACKSZSFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-10-7-11(2)9-12(8-10)14(17)13-5-4-6-16-15(13)18-3/h4-6,10-12,14,17H,7-9H2,1-3H3.
What are the key properties of (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol?
(3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol has a molecular weight of 249.35 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylcyclohexyl)-(2-methoxy-3-pyridinyl)methanol is sourced from PubChem (CID 105102871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).