7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]

C17H24N6 — CID 97440550

IUPAC7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
SMILESCCN1CCn2c(C)cnc2C12CCN(c1ncccn1)CC2
InChIInChI=1S/C17H24N6/c1-3-22-11-12-23-14(2)13-20-15(23)17(22)5-9-21(10-6-17)16-18-7-4-8-19-16/h4,7-8,13H,3,5-6,9-12H2,1-2H3
InChIKeyCQIWXJSIEJIOKD-UHFFFAOYSA-N
MW312.42 g/mol
LogP1.81
Rot. Bonds2

About 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]

7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] (PubChem CID 97440550) has the molecular formula C17H24N6 and a molecular weight of 312.42 g/mol. Its IUPAC name is 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine].

Molecular Properties

Compound Name7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
PubChem CID97440550
Molecular FormulaC17H24N6
Molecular Weight312.42 g/mol
Exact Mass312.21
IUPAC Name7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
SMILESCCN1CCn2c(C)cnc2C12CCN(c1ncccn1)CC2
InChIInChI=1S/C17H24N6/c1-3-22-11-12-23-14(2)13-20-15(23)17(22)5-9-21(10-6-17)16-18-7-4-8-19-16/h4,7-8,13H,3,5-6,9-12H2,1-2H3
InChIKeyCQIWXJSIEJIOKD-UHFFFAOYSA-N
XLogP1.81
TPSA50.08 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] with MolForge

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Related Compounds

7-ethyl-N,3-dimethylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-carboxamide;2,2,2-trifluoroacetic acid
CID 118743304
7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97361061
3-(3-fluorophenyl)-7-methylsulfonyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97440450
7-ethyl-3-phenyl-1'-(pyridin-3-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97361062
7-ethyl-3-(1-methylpyrazol-4-yl)-1'-(pyridin-4-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97361049
7-ethyl-3-phenyl-1'-(thiophen-3-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97361055
N-benzyl-7-ethyl-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-carboxamide
CID 97440535
(7-ethyl-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-yl)-(oxan-4-yl)methanone
CID 97361076
1-(7-ethyl-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-yl)-2-methylpropan-1-one;2,2,2-trifluoroacetic acid
CID 155857877
2,8-di(pyrimidin-2-yl)-2,8-diazaspiro[4.5]decane
CID 97369995
3,7-dimethyl-1'-(oxan-4-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97361034
2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane
CID 171070249

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]?
The IUPAC name of 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] (CID 97440550) is 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine].
What is the SMILES notation for 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]?
The canonical SMILES for 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] is CCN1CCn2c(C)cnc2C12CCN(c1ncccn1)CC2.
What is the InChIKey of 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]?
The InChIKey is CQIWXJSIEJIOKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6/c1-3-22-11-12-23-14(2)13-20-15(23)17(22)5-9-21(10-6-17)16-18-7-4-8-19-16/h4,7-8,13H,3,5-6,9-12H2,1-2H3.
What are the key properties of 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]?
7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] has a molecular weight of 312.42 g/mol, XLogP of 1.81, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-3-methyl-1'-pyrimidin-2-ylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] is sourced from PubChem (CID 97440550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).