7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]

C24H29N5 — CID 97361061

IUPAC7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
SMILESCCN1CCn2c(-c3ccccc3)cnc2C12CCN(Cc1ccccn1)CC2
InChIInChI=1S/C24H29N5/c1-2-28-16-17-29-22(20-8-4-3-5-9-20)18-26-23(29)24(28)11-14-27(15-12-24)19-21-10-6-7-13-25-21/h3-10,13,18H,2,11-12,14-17,19H2,1H3
InChIKeyJHSMHNXDPRDTDM-UHFFFAOYSA-N
MW387.53 g/mol
LogP3.77
Rot. Bonds4

About 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]

7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] (PubChem CID 97361061) has the molecular formula C24H29N5 and a molecular weight of 387.53 g/mol. Its IUPAC name is 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine].

Molecular Properties

Compound Name7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
PubChem CID97361061
Molecular FormulaC24H29N5
Molecular Weight387.53 g/mol
Exact Mass387.24
IUPAC Name7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
SMILESCCN1CCn2c(-c3ccccc3)cnc2C12CCN(Cc1ccccn1)CC2
InChIInChI=1S/C24H29N5/c1-2-28-16-17-29-22(20-8-4-3-5-9-20)18-26-23(29)24(28)11-14-27(15-12-24)19-21-10-6-7-13-25-21/h3-10,13,18H,2,11-12,14-17,19H2,1H3
InChIKeyJHSMHNXDPRDTDM-UHFFFAOYSA-N
XLogP3.77
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.53
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-ethyl-3-phenyl-1'-(pyridin-3-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97361062
7-ethyl-3-phenyl-1'-(thiophen-3-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97361055
7-ethyl-1'-(furan-2-ylmethyl)-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97361052
2-[(7-ethyl-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-yl)methyl]-1,3-thiazole;tris(2,2,2-trifluoroacetic acid)
CID 155825736
7-ethyl-1'-(furan-3-ylmethyl)-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];tris(2,2,2-trifluoroacetic acid)
CID 155842020
7-ethyl-1'-[(1-methylpyrazol-4-yl)methyl]-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];tris(2,2,2-trifluoroacetic acid)
CID 155845885
(7-ethyl-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-yl)-pyridin-2-ylmethanone;tris(2,2,2-trifluoroacetic acid)
CID 155837576
7-ethyl-3-(1-methylpyrazol-4-yl)-1'-(pyridin-4-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]
CID 97361049
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)-thiophen-2-ylmethanone
CID 97361072
(7-ethyl-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-yl)-(oxan-4-yl)methanone
CID 97361076
(7-ethyl-3-phenylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-yl)-(1,3-thiazol-4-yl)methanone
CID 97440539

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]?
The IUPAC name of 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] (CID 97361061) is 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine].
What is the SMILES notation for 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]?
The canonical SMILES for 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] is CCN1CCn2c(-c3ccccc3)cnc2C12CCN(Cc1ccccn1)CC2.
What is the InChIKey of 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]?
The InChIKey is JHSMHNXDPRDTDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5/c1-2-28-16-17-29-22(20-8-4-3-5-9-20)18-26-23(29)24(28)11-14-27(15-12-24)19-21-10-6-7-13-25-21/h3-10,13,18H,2,11-12,14-17,19H2,1H3.
What are the key properties of 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]?
7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] has a molecular weight of 387.53 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-3-phenyl-1'-(pyridin-2-ylmethyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine] is sourced from PubChem (CID 97361061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).