1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine

C20H30N2O — CID 24771108

IUPAC1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine
SMILESc1cc2c(cc1OCCN1CCCCC1)C(N1CCCC1)CC2
InChIInChI=1S/C20H30N2O/c1-2-10-21(11-3-1)14-15-23-18-8-6-17-7-9-20(19(17)16-18)22-12-4-5-13-22/h6,8,16,20H,1-5,7,9-15H2
InChIKeyVEPCZWIOFYLYHN-UHFFFAOYSA-N
MW314.47 g/mol
LogP3.63
Rot. Bonds5

About 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine

1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine (PubChem CID 24771108) has the molecular formula C20H30N2O and a molecular weight of 314.47 g/mol. Its IUPAC name is 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine.

Molecular Properties

Compound Name1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine
PubChem CID24771108
Molecular FormulaC20H30N2O
Molecular Weight314.47 g/mol
Exact Mass314.24
IUPAC Name1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine
SMILESc1cc2c(cc1OCCN1CCCCC1)C(N1CCCC1)CC2
InChIInChI=1S/C20H30N2O/c1-2-10-21(11-3-1)14-15-23-18-8-6-17-7-9-20(19(17)16-18)22-12-4-5-13-22/h6,8,16,20H,1-5,7,9-15H2
InChIKeyVEPCZWIOFYLYHN-UHFFFAOYSA-N
XLogP3.63
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.47
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-(3-piperidin-1-ylpropoxy)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline
CID 143379957
1-[6-(2-pyrrolidin-1-ylethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine
CID 24771157
2-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]-1-azabicyclo[2.2.1]heptane
CID 24771397
N-ethyl-2-[4-(6-propoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]acetamide
CID 139706623
ethane;2-[[8-(4-phosphanylpiperazin-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]ethanamine
CID 90811726
1-[2-(3,4-dimethylphenoxy)ethyl]azepane
CID 82086608
8-piperidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 86154069
3-[3-oxo-6-(2-piperidin-1-ylethoxy)-1H-isoindol-2-yl]piperidine-2,6-dione
CID 166875832
2-[(6S,10bS)-9-(3-piperidin-1-ylpropoxy)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinolin-6-yl]phenol
CID 59383330
2-[4-(6-ethoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]-N-ethylacetamide
CID 139706624
1-[2-(4-chloro-3-fluorophenoxy)ethyl]pyrrolidine
CID 82727267
2-chloro-4-(2-pyrrolidin-1-ylethoxy)aniline
CID 107910973

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine?
The IUPAC name of 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine (CID 24771108) is 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine.
What is the SMILES notation for 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine?
The canonical SMILES for 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine is c1cc2c(cc1OCCN1CCCCC1)C(N1CCCC1)CC2.
What is the InChIKey of 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine?
The InChIKey is VEPCZWIOFYLYHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O/c1-2-10-21(11-3-1)14-15-23-18-8-6-17-7-9-20(19(17)16-18)22-12-4-5-13-22/h6,8,16,20H,1-5,7,9-15H2.
What are the key properties of 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine?
1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine has a molecular weight of 314.47 g/mol, XLogP of 3.63, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(3-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]ethyl]piperidine is sourced from PubChem (CID 24771108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).