5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole

C24H29N3O — CID 25166033

IUPAC5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole
SMILESCOc1ccc2[nH]cc(C3CCC(N4CCN(c5ccccc5)CC4)C3)c2c1
InChIInChI=1S/C24H29N3O/c1-28-21-9-10-24-22(16-21)23(17-25-24)18-7-8-20(15-18)27-13-11-26(12-14-27)19-5-3-2-4-6-19/h2-6,9-10,16-18,20,25H,7-8,11-15H2,1H3
InChIKeyOGYQRGKNJBTSHM-UHFFFAOYSA-N
MW375.52 g/mol
LogP4.63
Rot. Bonds4

About 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole

5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole (PubChem CID 25166033) has the molecular formula C24H29N3O and a molecular weight of 375.52 g/mol. Its IUPAC name is 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole.

Molecular Properties

Compound Name5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole
PubChem CID25166033
Molecular FormulaC24H29N3O
Molecular Weight375.52 g/mol
Exact Mass375.23
IUPAC Name5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole
SMILESCOc1ccc2[nH]cc(C3CCC(N4CCN(c5ccccc5)CC4)C3)c2c1
InChIInChI=1S/C24H29N3O/c1-28-21-9-10-24-22(16-21)23(17-25-24)18-7-8-20(15-18)27-13-11-26(12-14-27)19-5-3-2-4-6-19/h2-6,9-10,16-18,20,25H,7-8,11-15H2,1H3
InChIKeyOGYQRGKNJBTSHM-UHFFFAOYSA-N
XLogP4.63
TPSA31.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.52
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[3-(5-methoxy-1H-indol-3-yl)cyclopentyl]piperazin-1-yl]benzonitrile
CID 25165845
3-[3-[4-(3-chlorophenyl)piperazin-1-yl]cyclopentyl]-1H-indole
CID 25165253
4-(5-methoxy-1H-indol-3-yl)cyclohexane-1-carboxylic acid
CID 83788644
5-methoxy-3-(1-propan-2-ylpiperidin-4-yl)-1H-indole
CID 47538804
2-[4-[3-(5-fluoro-1H-indol-3-yl)cyclopentyl]piperazin-1-yl]benzonitrile
CID 25165455
3-[1-[2-(difluoromethylsulfonyl)phenyl]piperidin-4-yl]-5-methoxy-1H-indole
CID 133298637
3-(1-cyclohex-2-en-1-ylpiperidin-4-yl)-5-methoxy-1H-indole
CID 56574521
3-[1-[3-(4-cyclobutylpiperazin-1-yl)-4-methoxyphenyl]sulfonylpiperidin-4-yl]-5-methoxy-1H-indole
CID 163880260
3-[(2S)-azetidin-2-yl]-5-methoxy-1H-indole
CID 171196660
3-(3-pyrrolidin-1-ylcyclopentyl)-1H-indole-5-carbonitrile
CID 10333844
[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]-(3-methoxyphenyl)methanone
CID 113087534
5-[4-(5-methoxy-1H-indol-3-yl)piperidine-1-carbonyl]thiophene-2-carboxylic acid
CID 167745823

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole?
The IUPAC name of 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole (CID 25166033) is 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole.
What is the SMILES notation for 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole?
The canonical SMILES for 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole is COc1ccc2[nH]cc(C3CCC(N4CCN(c5ccccc5)CC4)C3)c2c1.
What is the InChIKey of 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole?
The InChIKey is OGYQRGKNJBTSHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O/c1-28-21-9-10-24-22(16-21)23(17-25-24)18-7-8-20(15-18)27-13-11-26(12-14-27)19-5-3-2-4-6-19/h2-6,9-10,16-18,20,25H,7-8,11-15H2,1H3.
What are the key properties of 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole?
5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole has a molecular weight of 375.52 g/mol, XLogP of 4.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-[3-(4-phenylpiperazin-1-yl)cyclopentyl]-1H-indole is sourced from PubChem (CID 25166033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).