2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole

C35H46N6 — CID 123365227

IUPAC2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole
SMILESCC1CNC(C2N=C(c3ccc(-c4ccc(C5=NC(C6CC(C)CN6)NC5)c5c4C4(CCCC4)CC5)cc3)CN2)C1
InChIInChI=1S/C35H46N6/c1-21-15-28(36-17-21)33-38-19-30(40-33)24-7-5-23(6-8-24)25-9-10-26(27-11-14-35(32(25)27)12-3-4-13-35)31-20-39-34(41-31)29-16-22(2)18-37-29/h5-10,21-22,28-29,33-34,36-39H,3-4,11-20H2,1-2H3
InChIKeyUXCUAWZLZKXXDO-UHFFFAOYSA-N
MW550.80 g/mol
LogP4.54
Rot. Bonds5

About 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole

2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole (PubChem CID 123365227) has the molecular formula C35H46N6 and a molecular weight of 550.80 g/mol. Its IUPAC name is 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole
PubChem CID123365227
Molecular FormulaC35H46N6
Molecular Weight550.80 g/mol
Exact Mass550.38
IUPAC Name2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole
SMILESCC1CNC(C2N=C(c3ccc(-c4ccc(C5=NC(C6CC(C)CN6)NC5)c5c4C4(CCCC4)CC5)cc3)CN2)C1
InChIInChI=1S/C35H46N6/c1-21-15-28(36-17-21)33-38-19-30(40-33)24-7-5-23(6-8-24)25-9-10-26(27-11-14-35(32(25)27)12-3-4-13-35)31-20-39-34(41-31)29-16-22(2)18-37-29/h5-10,21-22,28-29,33-34,36-39H,3-4,11-20H2,1-2H3
InChIKeyUXCUAWZLZKXXDO-UHFFFAOYSA-N
XLogP4.54
TPSA72.84 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms41
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500550.80
LogP ≤ 54.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole with MolForge

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Related Compounds

2-(5-ethyl-4-methylpyrrolidin-2-yl)-4-[4-[6-[2-(5-ethyl-4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]naphthalen-2-yl]phenyl]-2,5-dihydro-1H-imidazole
CID 123246985
2-[4-[4-[7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)spiro[1,2-dihydroindene-3,1'-cyclopentane]-4-yl]phenyl]-2,5-dihydro-1H-imidazol-2-yl]piperidine
CID 123441729
N-(2-azabicyclo[3.1.0]hexan-3-ylmethyl)-1-[4-[7-[4-[2-(2-azabicyclo[3.1.0]hex-5-en-3-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3,5,6-tetrahydroindene-1,1'-cyclopentane]-4-yl]cyclohexa-1,3-dien-1-yl]ethanimine
CID 123676012
2-pyrrolidin-2-yl-4-[6-(2-pyrrolidin-2-yl-2,5-dihydro-1H-imidazol-4-yl)naphthalen-2-yl]-2,5-dihydro-1H-imidazole
CID 123739304
2-pyrrolidin-2-yl-4-[7-[4-(2-pyrrolidin-2-yl-2,5-dihydro-1H-imidazol-4-yl)cyclohexyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole
CID 123749507
2-[(2S,4S)-4-methylpyrrolidin-2-yl]-4-[7-[4-[2-[(2S,4S)-4-methylpyrrolidin-2-yl]-2,3-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,3-dihydro-1H-imidazole
CID 144594012
N-[2-[5-[9-(4-cyclohexa-1,5-dien-1-yl-6-phenyl-2,3-dihydropyridin-2-yl)-2,3,4b,5,6,8a-hexahydrocarbazol-3-yl]-2-ethylphenyl]cyclohexa-1,5-dien-1-yl]-9,9-dimethyl-2,3,4b,8a-tetrahydrofluoren-3-amine
CID 146658692
N-[2-methyl-1-(1,1,2,2,3,3,9,9-octamethylcyclopenta[b]fluoren-7-yl)propylidene]pyrrolidine-1-carboximidamide
CID 173709606
2-[(2S)-pyrrolidin-2-yl]-4-[6-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]-3-tricyclo[6.2.1.02,7]undeca-2,4,6-trienyl]-3H-pyrrole
CID 157877359
2-pyrrolidin-2-yl-4-[6-[4-(2-pyrrolidin-2-yl-3H-pyrrol-4-yl)phenyl]-3-tricyclo[6.2.1.02,7]undeca-2,4,6-trienyl]-3H-pyrrole
CID 160499253
2-[(2S)-4-methyl-2,5-dihydro-1H-pyrrol-2-yl]-4-[7-[4-[2-[(2S)-4-methyl-2,5-dihydro-1H-pyrrol-2-yl]-3H-pyrrol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-3H-pyrrole
CID 161155782

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole?
The IUPAC name of 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole (CID 123365227) is 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole?
The canonical SMILES for 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole is CC1CNC(C2N=C(c3ccc(-c4ccc(C5=NC(C6CC(C)CN6)NC5)c5c4C4(CCCC4)CC5)cc3)CN2)C1.
What is the InChIKey of 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole?
The InChIKey is UXCUAWZLZKXXDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H46N6/c1-21-15-28(36-17-21)33-38-19-30(40-33)24-7-5-23(6-8-24)25-9-10-26(27-11-14-35(32(25)27)12-3-4-13-35)31-20-39-34(41-31)29-16-22(2)18-37-29/h5-10,21-22,28-29,33-34,36-39H,3-4,11-20H2,1-2H3.
What are the key properties of 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole?
2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole has a molecular weight of 550.80 g/mol, XLogP of 4.54, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpyrrolidin-2-yl)-4-[7-[4-[2-(4-methylpyrrolidin-2-yl)-2,5-dihydro-1H-imidazol-4-yl]phenyl]spiro[2,3-dihydroindene-1,1'-cyclopentane]-4-yl]-2,5-dihydro-1H-imidazole is sourced from PubChem (CID 123365227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).