2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol

C14H16N2O — CID 137004600

IUPAC2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol
SMILESCC1CCCc2cnc(-c3ccccc3O)n21
InChIInChI=1S/C14H16N2O/c1-10-5-4-6-11-9-15-14(16(10)11)12-7-2-3-8-13(12)17/h2-3,7-10,17H,4-6H2,1H3
InChIKeyCDERBWOGUVRCCL-UHFFFAOYSA-N
MW228.30 g/mol
LogP3.15
Rot. Bonds1

About 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol

2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol (PubChem CID 137004600) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol.

Molecular Properties

Compound Name2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol
PubChem CID137004600
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol
SMILESCC1CCCc2cnc(-c3ccccc3O)n21
InChIInChI=1S/C14H16N2O/c1-10-5-4-6-11-9-15-14(16(10)11)12-7-2-3-8-13(12)17/h2-3,7-10,17H,4-6H2,1H3
InChIKeyCDERBWOGUVRCCL-UHFFFAOYSA-N
XLogP3.15
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol?
The IUPAC name of 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol (CID 137004600) is 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol.
What is the SMILES notation for 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol?
The canonical SMILES for 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol is CC1CCCc2cnc(-c3ccccc3O)n21.
What is the InChIKey of 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol?
The InChIKey is CDERBWOGUVRCCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-10-5-4-6-11-9-15-14(16(10)11)12-7-2-3-8-13(12)17/h2-3,7-10,17H,4-6H2,1H3.
What are the key properties of 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol?
2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol has a molecular weight of 228.30 g/mol, XLogP of 3.15, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenol is sourced from PubChem (CID 137004600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).