6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol

C9H15NO — CID 165106739

IUPAC6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol
SMILESCC1=CC(O)=C(C(C)C)CN1
InChIInChI=1S/C9H15NO/c1-6(2)8-5-10-7(3)4-9(8)11/h4,6,10-11H,5H2,1-3H3
InChIKeyZGOLUQQWKFGIRD-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.96
Rot. Bonds1

About 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol

6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol (PubChem CID 165106739) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol.

Molecular Properties

Compound Name6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol
PubChem CID165106739
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol
SMILESCC1=CC(O)=C(C(C)C)CN1
InChIInChI=1S/C9H15NO/c1-6(2)8-5-10-7(3)4-9(8)11/h4,6,10-11H,5H2,1-3H3
InChIKeyZGOLUQQWKFGIRD-UHFFFAOYSA-N
XLogP1.96
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol?
The IUPAC name of 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol (CID 165106739) is 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol.
What is the SMILES notation for 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol?
The canonical SMILES for 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol is CC1=CC(O)=C(C(C)C)CN1.
What is the InChIKey of 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol?
The InChIKey is ZGOLUQQWKFGIRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-6(2)8-5-10-7(3)4-9(8)11/h4,6,10-11H,5H2,1-3H3.
What are the key properties of 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol?
6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol has a molecular weight of 153.22 g/mol, XLogP of 1.96, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol is sourced from PubChem (CID 165106739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).