2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol

C9H15NO — CID 90247451

IUPAC2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol
SMILESCC1=CC=CC(C(C)(C)O)N1
InChIInChI=1S/C9H15NO/c1-7-5-4-6-8(10-7)9(2,3)11/h4-6,8,10-11H,1-3H3
InChIKeyMISUZGHTYXKACR-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.19
Rot. Bonds1

About 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol

2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol (PubChem CID 90247451) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol
PubChem CID90247451
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol
SMILESCC1=CC=CC(C(C)(C)O)N1
InChIInChI=1S/C9H15NO/c1-7-5-4-6-8(10-7)9(2,3)11/h4-6,8,10-11H,1-3H3
InChIKeyMISUZGHTYXKACR-UHFFFAOYSA-N
XLogP1.19
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 ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol?
The IUPAC name of 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol (CID 90247451) is 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol.
What is the SMILES notation for 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol?
The canonical SMILES for 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol is CC1=CC=CC(C(C)(C)O)N1.
What is the InChIKey of 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol?
The InChIKey is MISUZGHTYXKACR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-7-5-4-6-8(10-7)9(2,3)11/h4-6,8,10-11H,1-3H3.
What are the key properties of 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol?
2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol has a molecular weight of 153.22 g/mol, XLogP of 1.19, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-1,2-dihydropyridin-2-yl)propan-2-ol is sourced from PubChem (CID 90247451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).