1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one

C16H26N4O — CID 140912294

IUPAC1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one
SMILESCC(C)CC(=O)N1CCC(N2CCn3cncc3C2)CC1
InChIInChI=1S/C16H26N4O/c1-13(2)9-16(21)18-5-3-14(4-6-18)19-7-8-20-12-17-10-15(20)11-19/h10,12-14H,3-9,11H2,1-2H3
InChIKeyKREOTUFRWHNKSI-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.74
Rot. Bonds3

About 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one

1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one (PubChem CID 140912294) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one.

Molecular Properties

Compound Name1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one
PubChem CID140912294
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one
SMILESCC(C)CC(=O)N1CCC(N2CCn3cncc3C2)CC1
InChIInChI=1S/C16H26N4O/c1-13(2)9-16(21)18-5-3-14(4-6-18)19-7-8-20-12-17-10-15(20)11-19/h10,12-14H,3-9,11H2,1-2H3
InChIKeyKREOTUFRWHNKSI-UHFFFAOYSA-N
XLogP1.74
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-diisopropyl-5,6-dihydroimidazo[1,5-a]pyrazine-7(8H)-carboxamide
CID 56889516
N-[1-(5,6-dihydroimidazo[1,5-a]pyrazin-7(8H)-ylcarbonyl)-2-methylpropyl]acetamide
CID 56905957
7-(2-Pyrrolidin-1-ylpropanoyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
CID 56915004
2-[(3-Cyclohexylimidazol-4-yl)methyl]-7-methyl-2,7-diazaspiro[4.5]decan-6-one
CID 72933218
7-ethyl-N,N,3-trimethylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-carboxamide
CID 97361095
7-(cyclopropylmethyl)-2-(piperidin-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97382065
2-cyclopropyl-N-[[7-(cyclopropylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide
CID 97382111
2-[[(2-cyclopropylacetyl)amino]methyl]-N,N-dimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
CID 97382117
[3-[(4-methylpiperazin-1-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone
CID 97384425
[2-[(4-methylpiperazin-1-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone
CID 97408444
1-(3,7-Dimethylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-yl)-3-methylbutan-1-one
CID 97440495
1-(7-Ethyl-3-methylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-yl)-3-methylbutan-1-one
CID 97440546

Frequently Asked Questions

What is the IUPAC name of 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one?
The IUPAC name of 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one (CID 140912294) is 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one.
What is the SMILES notation for 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one?
The canonical SMILES for 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one is CC(C)CC(=O)N1CCC(N2CCn3cncc3C2)CC1.
What is the InChIKey of 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one?
The InChIKey is KREOTUFRWHNKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-13(2)9-16(21)18-5-3-14(4-6-18)19-7-8-20-12-17-10-15(20)11-19/h10,12-14H,3-9,11H2,1-2H3.
What are the key properties of 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one?
1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one has a molecular weight of 290.41 g/mol, XLogP of 1.74, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)piperidin-1-yl]-3-methylbutan-1-one is sourced from PubChem (CID 140912294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).