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

C13H20N4O — CID 110476632

IUPAC(4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
SMILESCN1CCN(C(=O)C2CCn3cncc3C2)CC1
InChIInChI=1S/C13H20N4O/c1-15-4-6-16(7-5-15)13(18)11-2-3-17-10-14-9-12(17)8-11/h9-11H,2-8H2,1H3
InChIKeyZEJYOHLTSWPYDT-UHFFFAOYSA-N
MW248.33 g/mol
LogP0.22
Rot. Bonds1

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

(4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone (PubChem CID 110476632) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is (4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone.

Molecular Properties

Compound Name(4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
PubChem CID110476632
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name(4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
SMILESCN1CCN(C(=O)C2CCn3cncc3C2)CC1
InChIInChI=1S/C13H20N4O/c1-15-4-6-16(7-5-15)13(18)11-2-3-17-10-14-9-12(17)8-11/h9-11H,2-8H2,1H3
InChIKeyZEJYOHLTSWPYDT-UHFFFAOYSA-N
XLogP0.22
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(3-methylphenyl)piperazin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
CID 84578391
(2-methylpiperidin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
CID 84578850
(3,4-dichlorophenyl)-[1-[(7R)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl]piperidin-4-yl]methanone
CID 97239174
[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-[(7R)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl]methanone
CID 97011145
1-(cyclopentylmethyl)-4-[(7S)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl]piperazin-2-one
CID 97241667
N-cyclohexyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
CID 84578888
N-(3,5-dimethyl-1H-pyrazol-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
CID 112525207
N-(3-methyl-1,2-thiazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
CID 84594830
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
CID 139000026
5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)methanone
CID 127675377
(5-amino-2-methylindol-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
CID 112526157
(6-amino-2-methylbenzimidazol-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone
CID 112523690

Frequently Asked Questions

What is the IUPAC name of (4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone?
The IUPAC name of (4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone (CID 110476632) is (4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone.
What is the SMILES notation for (4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone?
The canonical SMILES for (4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone is CN1CCN(C(=O)C2CCn3cncc3C2)CC1.
What is the InChIKey of (4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone?
The InChIKey is ZEJYOHLTSWPYDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-15-4-6-16(7-5-15)13(18)11-2-3-17-10-14-9-12(17)8-11/h9-11H,2-8H2,1H3.
What are the key properties of (4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone?
(4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone has a molecular weight of 248.33 g/mol, XLogP of 0.22, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)methanone is sourced from PubChem (CID 110476632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).