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

C12H13ClN2O2 — CID 117150953

IUPAC[3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol
SMILESOCC1CCn2c(cnc2-c2ccc(Cl)o2)C1
InChIInChI=1S/C12H13ClN2O2/c13-11-2-1-10(17-11)12-14-6-9-5-8(7-16)3-4-15(9)12/h1-2,6,8,16H,3-5,7H2
InChIKeyYZRHUTRGNPNRHU-UHFFFAOYSA-N
MW252.70 g/mol
LogP2.35
Rot. Bonds2

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

[3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol (PubChem CID 117150953) has the molecular formula C12H13ClN2O2 and a molecular weight of 252.70 g/mol. Its IUPAC name is [3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol.

Molecular Properties

Compound Name[3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol
PubChem CID117150953
Molecular FormulaC12H13ClN2O2
Molecular Weight252.70 g/mol
Exact Mass252.07
IUPAC Name[3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol
SMILESOCC1CCn2c(cnc2-c2ccc(Cl)o2)C1
InChIInChI=1S/C12H13ClN2O2/c13-11-2-1-10(17-11)12-14-6-9-5-8(7-16)3-4-15(9)12/h1-2,6,8,16H,3-5,7H2
InChIKeyYZRHUTRGNPNRHU-UHFFFAOYSA-N
XLogP2.35
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.70
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol?
The IUPAC name of [3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol (CID 117150953) is [3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol.
What is the SMILES notation for [3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol?
The canonical SMILES for [3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol is OCC1CCn2c(cnc2-c2ccc(Cl)o2)C1.
What is the InChIKey of [3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol?
The InChIKey is YZRHUTRGNPNRHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2O2/c13-11-2-1-10(17-11)12-14-6-9-5-8(7-16)3-4-15(9)12/h1-2,6,8,16H,3-5,7H2.
What are the key properties of [3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol?
[3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol has a molecular weight of 252.70 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-chlorofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanol is sourced from PubChem (CID 117150953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).