tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate

C16H23N5O2 — CID 10425966

IUPACtert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate
SMILESCc1cn2ccnc2c(N2CCN(C(=O)OC(C)(C)C)CC2)n1
InChIInChI=1S/C16H23N5O2/c1-12-11-21-6-5-17-13(21)14(18-12)19-7-9-20(10-8-19)15(22)23-16(2,3)4/h5-6,11H,7-10H2,1-4H3
InChIKeyNXSOVMJNFFLAPO-UHFFFAOYSA-N
MW317.39 g/mol
LogP2.09
Rot. Bonds1

About tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate

tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate (PubChem CID 10425966) has the molecular formula C16H23N5O2 and a molecular weight of 317.39 g/mol. Its IUPAC name is tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate
PubChem CID10425966
Molecular FormulaC16H23N5O2
Molecular Weight317.39 g/mol
Exact Mass317.19
IUPAC Nametert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate
SMILESCc1cn2ccnc2c(N2CCN(C(=O)OC(C)(C)C)CC2)n1
InChIInChI=1S/C16H23N5O2/c1-12-11-21-6-5-17-13(21)14(18-12)19-7-9-20(10-8-19)15(22)23-16(2,3)4/h5-6,11H,7-10H2,1-4H3
InChIKeyNXSOVMJNFFLAPO-UHFFFAOYSA-N
XLogP2.09
TPSA62.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

tert-butyl 4-(3-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate
CID 10313750
tert-butyl 4-(7-methylimidazo[1,2-b]pyridazin-6-yl)piperazine-1-carboxylate
CID 162360922
3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]pyrazine-2-carboxylic acid
CID 169205005
tert-butyl 4-(3-methoxy-2-pyridinyl)piperazine-1-carboxylate
CID 70571171
tert-butyl 4-(3-bromo-4-methyl-2-pyridinyl)piperazine-1-carboxylate
CID 176508616
tert-butyl 4-[3-(aminomethyl)-4,6-dimethyl-2-pyridinyl]piperazine-1-carboxylate
CID 104933395
tert-butyl 4-(8-phenylimidazo[1,2-a]pyrazine-2-carbonyl)piperazine-1-carboxylate
CID 53188849
tert-butyl 4-(5-iodo-6-methylpyrimidin-4-yl)piperazine-1-carboxylate
CID 156898021
tert-butyl 4-(3-chloro-6,7-dimethylquinoxalin-2-yl)piperazine-1-carboxylate
CID 166485451
tert-butyl 4-(5-methoxypyrimidin-4-yl)piperazine-1-carboxylate
CID 156898070
tert-butyl 4-(5-bromo-3-methyl-2-pyridinyl)piperazine-1-carboxylate
CID 46739269
3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]pyridine-2-carboxylic acid
CID 131739918

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate?
The IUPAC name of tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate (CID 10425966) is tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate?
The canonical SMILES for tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate is Cc1cn2ccnc2c(N2CCN(C(=O)OC(C)(C)C)CC2)n1.
What is the InChIKey of tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate?
The InChIKey is NXSOVMJNFFLAPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O2/c1-12-11-21-6-5-17-13(21)14(18-12)19-7-9-20(10-8-19)15(22)23-16(2,3)4/h5-6,11H,7-10H2,1-4H3.
What are the key properties of tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate?
tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate has a molecular weight of 317.39 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-(6-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate is sourced from PubChem (CID 10425966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).