2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone

C24H30N4O3 — CID 131642749

IUPAC2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone
SMILESO=C(Cc1ccccc1)N1CCC2(CC1)OC(C(=O)N1CCCCC1)Cn1ccnc12
InChIInChI=1S/C24H30N4O3/c29-21(17-19-7-3-1-4-8-19)26-14-9-24(10-15-26)23-25-11-16-28(23)18-20(31-24)22(30)27-12-5-2-6-13-27/h1,3-4,7-8,11,16,20H,2,5-6,9-10,12-15,17-18H2
InChIKeyPNFSTDKAHWNGQQ-UHFFFAOYSA-N
MW422.53 g/mol
LogP2.35
Rot. Bonds3

About 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone

2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone (PubChem CID 131642749) has the molecular formula C24H30N4O3 and a molecular weight of 422.53 g/mol. Its IUPAC name is 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone.

Molecular Properties

Compound Name2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone
PubChem CID131642749
Molecular FormulaC24H30N4O3
Molecular Weight422.53 g/mol
Exact Mass422.23
IUPAC Name2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone
SMILESO=C(Cc1ccccc1)N1CCC2(CC1)OC(C(=O)N1CCCCC1)Cn1ccnc12
InChIInChI=1S/C24H30N4O3/c29-21(17-19-7-3-1-4-8-19)26-14-9-24(10-15-26)23-25-11-16-28(23)18-20(31-24)22(30)27-12-5-2-6-13-27/h1,3-4,7-8,11,16,20H,2,5-6,9-10,12-15,17-18H2
InChIKeyPNFSTDKAHWNGQQ-UHFFFAOYSA-N
XLogP2.35
TPSA67.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone 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

2-Methyl-9-(2-phenylethyl)-4-pyrazin-2-yl-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 118567605
rac-1-(2-((1H-imidazol-1-yl)methyl)morpholino)-2-(4-fluorophenyl)ethanone
CID 46960541
(4aR,7aS)-4-[(1-methylimidazol-2-yl)methyl]-6-(3-phenylpropyl)-4a,5,7,7a-tetrahydropyrrolo[3,4-b][1,4]oxazin-3-one
CID 56775142
1-[4-Hydroxy-4-(1-methylimidazol-2-yl)piperidin-1-yl]-2-phenylethanone
CID 16671828
N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide
CID 75367225
4-Benzyl-9-[(1-methylimidazol-2-yl)methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 97451127
1-N'-[2-(4-fluorophenyl)ethyl]-6-N-methylspiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1',6-dicarboxamide
CID 131654024
1-N'-[2-(4-fluorophenyl)ethyl]-6-N,6-N-dimethylspiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1',6-dicarboxamide
CID 155901500
1-N'-[2-(4-fluorophenyl)ethyl]spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1',6-dicarboxamide
CID 155902292
1-[(3-fluorophenyl)acetyl]-3-[1-(2-methoxyethyl)-1H-imidazol-2-yl]piperidine
CID 70743575
2-(3-fluorophenyl)-1-[(3R)-3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]ethanone
CID 97130478
2-(3-fluorophenyl)-1-[(3S)-3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]ethanone
CID 97130479

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone?
The IUPAC name of 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone (CID 131642749) is 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone.
What is the SMILES notation for 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone?
The canonical SMILES for 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone is O=C(Cc1ccccc1)N1CCC2(CC1)OC(C(=O)N1CCCCC1)Cn1ccnc12.
What is the InChIKey of 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone?
The InChIKey is PNFSTDKAHWNGQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O3/c29-21(17-19-7-3-1-4-8-19)26-14-9-24(10-15-26)23-25-11-16-28(23)18-20(31-24)22(30)27-12-5-2-6-13-27/h1,3-4,7-8,11,16,20H,2,5-6,9-10,12-15,17-18H2.
What are the key properties of 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone?
2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone has a molecular weight of 422.53 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-[6-(piperidine-1-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-1'-yl]ethanone is sourced from PubChem (CID 131642749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).