5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]

C23H32N4O — CID 72840375

IUPAC5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]
SMILESCCN1CCc2[nH]cnc2C12CCN(Cc1cc3c(cc1OC)CCC3)CC2
InChIInChI=1S/C23H32N4O/c1-3-27-10-7-20-22(25-16-24-20)23(27)8-11-26(12-9-23)15-19-13-17-5-4-6-18(17)14-21(19)28-2/h13-14,16H,3-12,15H2,1-2H3,(H,24,25)
InChIKeyRESMGWCDZHICHP-UHFFFAOYSA-N
MW380.54 g/mol
LogP3.28
Rot. Bonds4

About 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]

5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine] (PubChem CID 72840375) has the molecular formula C23H32N4O and a molecular weight of 380.54 g/mol. Its IUPAC name is 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine].

Molecular Properties

Compound Name5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]
PubChem CID72840375
Molecular FormulaC23H32N4O
Molecular Weight380.54 g/mol
Exact Mass380.26
IUPAC Name5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]
SMILESCCN1CCc2[nH]cnc2C12CCN(Cc1cc3c(cc1OC)CCC3)CC2
InChIInChI=1S/C23H32N4O/c1-3-27-10-7-20-22(25-16-24-20)23(27)8-11-26(12-9-23)15-19-13-17-5-4-6-18(17)14-21(19)28-2/h13-14,16H,3-12,15H2,1-2H3,(H,24,25)
InChIKeyRESMGWCDZHICHP-UHFFFAOYSA-N
XLogP3.28
TPSA44.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.54
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine] with MolForge

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Related Compounds

5-butyl-1'-[(1-ethyl-5-methylpyrazol-4-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]
CID 72931768
5-[(5-ethylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methyl]-6-methylimidazo[2,1-b][1,3]thiazole
CID 72906237
(5-ethylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)-(5,6,7,8-tetrahydroquinolin-3-yl)methanone
CID 72929853
4-[(5-propylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methyl]-2,1,3-benzoxadiazole
CID 72920667
1'-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]-5-propylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]
CID 72871590
1'-[(5-phenyl-1H-pyrazol-4-yl)methyl]-5-propylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]
CID 72934730
3-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]-10-methyl-3,10-diazaspiro[5.6]dodecan-9-one
CID 77084715
(5-ethylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)methanone
CID 72859382
5-ethyl-1'-[3-(5-methylfuran-2-yl)butyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]
CID 72918214
1-[1'-[(2-ethoxyphenyl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]propan-1-one
CID 72908241
3-methyl-5-[[5-(2-methylpropyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl]methyl]-1,2-oxazole
CID 72854623
(5-ethylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)-[5-(methoxymethyl)thiophen-2-yl]methanone
CID 72868232

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]?
The IUPAC name of 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine] (CID 72840375) is 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine].
What is the SMILES notation for 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]?
The canonical SMILES for 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine] is CCN1CCc2[nH]cnc2C12CCN(Cc1cc3c(cc1OC)CCC3)CC2.
What is the InChIKey of 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]?
The InChIKey is RESMGWCDZHICHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4O/c1-3-27-10-7-20-22(25-16-24-20)23(27)8-11-26(12-9-23)15-19-13-17-5-4-6-18(17)14-21(19)28-2/h13-14,16H,3-12,15H2,1-2H3,(H,24,25).
What are the key properties of 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]?
5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine] has a molecular weight of 380.54 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1'-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine] is sourced from PubChem (CID 72840375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).