[3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol

C14H22N2O2 — CID 117150853

IUPAC[3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol
SMILESOCC1CCn2c(cnc2CC2CCOCC2)C1
InChIInChI=1S/C14H22N2O2/c17-10-12-1-4-16-13(7-12)9-15-14(16)8-11-2-5-18-6-3-11/h9,11-12,17H,1-8,10H2
InChIKeyIBBNMHJCDUUYKQ-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.41
Rot. Bonds3

About [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol

[3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol (PubChem CID 117150853) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol.

Molecular Properties

Compound Name[3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol
PubChem CID117150853
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name[3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol
SMILESOCC1CCn2c(cnc2CC2CCOCC2)C1
InChIInChI=1S/C14H22N2O2/c17-10-12-1-4-16-13(7-12)9-15-14(16)8-11-2-5-18-6-3-11/h9,11-12,17H,1-8,10H2
InChIKeyIBBNMHJCDUUYKQ-UHFFFAOYSA-N
XLogP1.41
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol?
The IUPAC name of [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol (CID 117150853) is [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol.
What is the SMILES notation for [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol?
The canonical SMILES for [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol is OCC1CCn2c(cnc2CC2CCOCC2)C1.
What is the InChIKey of [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol?
The InChIKey is IBBNMHJCDUUYKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c17-10-12-1-4-16-13(7-12)9-15-14(16)8-11-2-5-18-6-3-11/h9,11-12,17H,1-8,10H2.
What are the key properties of [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol?
[3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol has a molecular weight of 250.34 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(oxan-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol is sourced from PubChem (CID 117150853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).