[3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol

C13H22N4O — CID 116984511

IUPAC[3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol
SMILESCN1CCNC(c2nc(CO)c3n2CCCC3)C1
InChIInChI=1S/C13H22N4O/c1-16-7-5-14-10(8-16)13-15-11(9-18)12-4-2-3-6-17(12)13/h10,14,18H,2-9H2,1H3
InChIKeyOWTHEBWVYNZSAO-UHFFFAOYSA-N
MW250.35 g/mol
LogP0.29
Rot. Bonds2

About [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol

[3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol (PubChem CID 116984511) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol.

Molecular Properties

Compound Name[3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol
PubChem CID116984511
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name[3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol
SMILESCN1CCNC(c2nc(CO)c3n2CCCC3)C1
InChIInChI=1S/C13H22N4O/c1-16-7-5-14-10(8-16)13-15-11(9-18)12-4-2-3-6-17(12)13/h10,14,18H,2-9H2,1H3
InChIKeyOWTHEBWVYNZSAO-UHFFFAOYSA-N
XLogP0.29
TPSA53.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol?
The IUPAC name of [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol (CID 116984511) is [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol.
What is the SMILES notation for [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol?
The canonical SMILES for [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol is CN1CCNC(c2nc(CO)c3n2CCCC3)C1.
What is the InChIKey of [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol?
The InChIKey is OWTHEBWVYNZSAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-16-7-5-14-10(8-16)13-15-11(9-18)12-4-2-3-6-17(12)13/h10,14,18H,2-9H2,1H3.
What are the key properties of [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol?
[3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol has a molecular weight of 250.35 g/mol, XLogP of 0.29, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol is sourced from PubChem (CID 116984511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).