[3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol

C18H27NO2 — CID 79646252

IUPAC[3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCC(Oc2ccc3c(c2)CCC3)C1
InChIInChI=1S/C18H27NO2/c1-2-10-19-18(13-20)9-8-17(12-18)21-16-7-6-14-4-3-5-15(14)11-16/h6-7,11,17,19-20H,2-5,8-10,12-13H2,1H3
InChIKeyRYFOTDCJMCMPBA-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.84
Rot. Bonds6

About [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol

[3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol (PubChem CID 79646252) has the molecular formula C18H27NO2 and a molecular weight of 289.42 g/mol. Its IUPAC name is [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol
PubChem CID79646252
Molecular FormulaC18H27NO2
Molecular Weight289.42 g/mol
Exact Mass289.20
IUPAC Name[3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCC(Oc2ccc3c(c2)CCC3)C1
InChIInChI=1S/C18H27NO2/c1-2-10-19-18(13-20)9-8-17(12-18)21-16-7-6-14-4-3-5-15(14)11-16/h6-7,11,17,19-20H,2-5,8-10,12-13H2,1H3
InChIKeyRYFOTDCJMCMPBA-UHFFFAOYSA-N
XLogP2.84
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(3-fluoro-4-methylphenoxy)-1-(propylamino)cyclopentyl]methanol
CID 107171546
[3-phenoxy-1-(propylamino)cyclopentyl]methanol
CID 79645048
[1-(propylamino)-3-(4-propylphenoxy)cyclopentyl]methanol
CID 79645486
[3-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-(propylamino)cyclopentyl]methanol
CID 79644489
3-(2,3-dihydro-1H-inden-5-yloxy)-1-(methylamino)cyclopentane-1-carboxylic acid
CID 79649371
[3-(2-phenoxyethoxy)-1-(propylamino)cyclopentyl]methanol
CID 79646008
3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine
CID 79619329
[3-(2,4-difluorophenoxy)-1-(propylamino)cyclohexyl]methanol
CID 79638624
N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
CID 88611694
[2-[3-(hydroxymethyl)-3-(propylamino)cyclohexyl]oxyphenyl]methanol
CID 79638491
[1-(ethylamino)-3-(3-propan-2-ylphenoxy)cyclopentyl]methanol
CID 79645784
[1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol
CID 79646293

Frequently Asked Questions

What is the IUPAC name of [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol?
The IUPAC name of [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol (CID 79646252) is [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol.
What is the SMILES notation for [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol?
The canonical SMILES for [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol is CCCNC1(CO)CCC(Oc2ccc3c(c2)CCC3)C1.
What is the InChIKey of [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol?
The InChIKey is RYFOTDCJMCMPBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO2/c1-2-10-19-18(13-20)9-8-17(12-18)21-16-7-6-14-4-3-5-15(14)11-16/h6-7,11,17,19-20H,2-5,8-10,12-13H2,1H3.
What are the key properties of [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol?
[3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol has a molecular weight of 289.42 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol is sourced from PubChem (CID 79646252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).