1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol

C23H32N2O2 — CID 134108061

IUPAC1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol
SMILESOC1CCN(Cc2cn(CC3CC3)c3ccc(OC4CCCC4)cc23)CC1
InChIInChI=1S/C23H32N2O2/c26-19-9-11-24(12-10-19)15-18-16-25(14-17-5-6-17)23-8-7-21(13-22(18)23)27-20-3-1-2-4-20/h7-8,13,16-17,19-20,26H,1-6,9-12,14-15H2
InChIKeyQZGNHTMUQPECFX-UHFFFAOYSA-N
MW368.52 g/mol
LogP4.33
Rot. Bonds6

About 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol

1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol (PubChem CID 134108061) has the molecular formula C23H32N2O2 and a molecular weight of 368.52 g/mol. Its IUPAC name is 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol
PubChem CID134108061
Molecular FormulaC23H32N2O2
Molecular Weight368.52 g/mol
Exact Mass368.25
IUPAC Name1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol
SMILESOC1CCN(Cc2cn(CC3CC3)c3ccc(OC4CCCC4)cc23)CC1
InChIInChI=1S/C23H32N2O2/c26-19-9-11-24(12-10-19)15-18-16-25(14-17-5-6-17)23-8-7-21(13-22(18)23)27-20-3-1-2-4-20/h7-8,13,16-17,19-20,26H,1-6,9-12,14-15H2
InChIKeyQZGNHTMUQPECFX-UHFFFAOYSA-N
XLogP4.33
TPSA37.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.52
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[5-cyclopentyloxy-1-[(2,6-difluorophenyl)methyl]indol-3-yl]methyl]piperidin-4-ol
CID 134108056
1-[[5-[2-(4-chlorophenyl)ethoxy]-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol
CID 134108064
1-[[5-but-2-ynoxy-1-(2-cyclohexylethyl)indol-3-yl]methyl]piperidin-4-ol
CID 134108071
1-[[5-but-2-ynoxy-1-(3-methylbutyl)indol-3-yl]methyl]piperidin-4-ol
CID 134108065
[(3S)-1-[(1-ethyl-5-methoxyindol-3-yl)methyl]pyrrolidin-3-yl]methanol
CID 92589969
azepan-1-yl-[1-[(1-ethyl-5-methoxyindol-3-yl)methyl]piperidin-4-yl]methanone
CID 53117764
1-(cyclopropylmethyl)-5-methoxy-3-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methyl]indole
CID 18940861
1-[[1-[(5-chlorothiophen-2-yl)methyl]-5-[2-(4-methoxyphenyl)ethoxy]indol-3-yl]methyl]piperidin-4-ol
CID 134107829
N-[2-[cyclohexyl(methyl)amino]ethyl]-1-[(1-ethyl-5-methoxyindol-3-yl)methyl]piperidine-4-carboxamide
CID 20974080
1-(cyclopropylmethyl)-6-methoxy-4-oxoquinoline-3-carboxylic acid
CID 82247783
2-[5-methoxy-3-[[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]methyl]indol-1-yl]acetamide
CID 51596931
1-[(2-hydroxy-4-methoxyphenyl)methyl]piperidin-4-ol
CID 2845869

Frequently Asked Questions

What is the IUPAC name of 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol?
The IUPAC name of 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol (CID 134108061) is 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol.
What is the SMILES notation for 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol?
The canonical SMILES for 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol is OC1CCN(Cc2cn(CC3CC3)c3ccc(OC4CCCC4)cc23)CC1.
What is the InChIKey of 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol?
The InChIKey is QZGNHTMUQPECFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2O2/c26-19-9-11-24(12-10-19)15-18-16-25(14-17-5-6-17)23-8-7-21(13-22(18)23)27-20-3-1-2-4-20/h7-8,13,16-17,19-20,26H,1-6,9-12,14-15H2.
What are the key properties of 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol?
1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol has a molecular weight of 368.52 g/mol, XLogP of 4.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-cyclopentyloxy-1-(cyclopropylmethyl)indol-3-yl]methyl]piperidin-4-ol is sourced from PubChem (CID 134108061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).