1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol

C13H18N2O — CID 167081405

IUPAC1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol
SMILESCC1=CN(C)CC=C1N1CC=C(O)C=C1C
InChIInChI=1S/C13H18N2O/c1-10-9-14(3)6-5-13(10)15-7-4-12(16)8-11(15)2/h4-5,8-9,16H,6-7H2,1-3H3
InChIKeyRCELPCMZSSNGFW-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.38
Rot. Bonds1

About 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol

1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol (PubChem CID 167081405) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol.

Molecular Properties

Compound Name1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol
PubChem CID167081405
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol
SMILESCC1=CN(C)CC=C1N1CC=C(O)C=C1C
InChIInChI=1S/C13H18N2O/c1-10-9-14(3)6-5-13(10)15-7-4-12(16)8-11(15)2/h4-5,8-9,16H,6-7H2,1-3H3
InChIKeyRCELPCMZSSNGFW-UHFFFAOYSA-N
XLogP2.38
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol?
The IUPAC name of 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol (CID 167081405) is 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol.
What is the SMILES notation for 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol?
The canonical SMILES for 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol is CC1=CN(C)CC=C1N1CC=C(O)C=C1C.
What is the InChIKey of 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol?
The InChIKey is RCELPCMZSSNGFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-10-9-14(3)6-5-13(10)15-7-4-12(16)8-11(15)2/h4-5,8-9,16H,6-7H2,1-3H3.
What are the key properties of 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol?
1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol has a molecular weight of 218.30 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,5-dimethyl-2H-pyridin-4-yl)-6-methyl-2H-pyridin-4-ol is sourced from PubChem (CID 167081405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).