2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole

C24H30N4 — CID 58516338

IUPAC2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole
SMILESC1=C(c2ccc(CCc3cnc(C4CCCC4)[nH]3)cc2)CC([C@@H]2CCCN2)=N1
InChIInChI=1S/C24H30N4/c1-2-5-19(4-1)24-27-16-21(28-24)12-9-17-7-10-18(11-8-17)20-14-23(26-15-20)22-6-3-13-25-22/h7-8,10-11,15-16,19,22,25H,1-6,9,12-14H2,(H,27,28)/t22-/m0/s1
InChIKeyHUJFYJGXLWUXCX-QFIPXVFZSA-N
MW374.53 g/mol
LogP4.79
Rot. Bonds6

About 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole

2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole (PubChem CID 58516338) has the molecular formula C24H30N4 and a molecular weight of 374.53 g/mol. Its IUPAC name is 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole.

Molecular Properties

Compound Name2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole
PubChem CID58516338
Molecular FormulaC24H30N4
Molecular Weight374.53 g/mol
Exact Mass374.25
IUPAC Name2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole
SMILESC1=C(c2ccc(CCc3cnc(C4CCCC4)[nH]3)cc2)CC([C@@H]2CCCN2)=N1
InChIInChI=1S/C24H30N4/c1-2-5-19(4-1)24-27-16-21(28-24)12-9-17-7-10-18(11-8-17)20-14-23(26-15-20)22-6-3-13-25-22/h7-8,10-11,15-16,19,22,25H,1-6,9,12-14H2,(H,27,28)/t22-/m0/s1
InChIKeyHUJFYJGXLWUXCX-QFIPXVFZSA-N
XLogP4.79
TPSA53.07 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.53
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopentyl-5-[4-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]buta-1,3-diynyl]-1H-imidazole
CID 157338327
[2-[4-(2-cyclopentyl-1H-imidazol-5-yl)phenyl]-5-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]methanol
CID 58490822
2-[(2S)-pyrrolidin-2-yl]-5-[4-[2-[2-[(2S)-pyrrolidin-2-yl]-1H-imidazol-5-yl]ethyl]phenyl]-1H-imidazole
CID 67003843
2-cyclopentyl-6-[4-[2-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]ethyl]phenyl]-1H-benzimidazole
CID 58384809
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CID 58384734
3-(2-cyclopentyl-3H-pyrrol-4-yl)-7-[5-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]-2-pyridinyl]quinoline
CID 58257351
3-(2-cyclopentyl-3H-pyrrol-4-yl)-6-[4-[2-[(2S)-pyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]pyridazine
CID 58490855
11-[2-[(2S)-pyrrolidin-2-yl]-1H-imidazol-5-yl]-4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]-8-oxa-1-azatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene
CID 158707001
5-[6-[4-[5-chloro-2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]naphthalen-2-yl]-2-cyclopentyl-1H-imidazole
CID 58501732
(2-cyclopentyl-1H-imidazol-5-yl)methanamine
CID 63108808
2-[(2S)-pyrrolidin-2-yl]-5-[4-[[4-[2-[(2S)-pyrrolidin-2-yl]-1H-imidazol-5-yl]phenoxy]methyl]phenyl]-1H-imidazole
CID 58209611
N-[(2-cyclooctyl-1H-imidazol-5-yl)methyl]cyclopropanamine
CID 80611809

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole?
The IUPAC name of 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole (CID 58516338) is 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole.
What is the SMILES notation for 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole?
The canonical SMILES for 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole is C1=C(c2ccc(CCc3cnc(C4CCCC4)[nH]3)cc2)CC([C@@H]2CCCN2)=N1.
What is the InChIKey of 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole?
The InChIKey is HUJFYJGXLWUXCX-QFIPXVFZSA-N. The full InChI is InChI=1S/C24H30N4/c1-2-5-19(4-1)24-27-16-21(28-24)12-9-17-7-10-18(11-8-17)20-14-23(26-15-20)22-6-3-13-25-22/h7-8,10-11,15-16,19,22,25H,1-6,9,12-14H2,(H,27,28)/t22-/m0/s1.
What are the key properties of 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole?
2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole has a molecular weight of 374.53 g/mol, XLogP of 4.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-[2-[4-[2-[(2S)-pyrrolidin-2-yl]-3H-pyrrol-4-yl]phenyl]ethyl]-1H-imidazole is sourced from PubChem (CID 58516338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).