1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine

C19H27NO — CID 91156879

IUPAC1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine
SMILESc1ccc2c(c1)CC(C1CCCCO1)C2N1CCCCC1
InChIInChI=1S/C19H27NO/c1-5-11-20(12-6-1)19-16-9-3-2-8-15(16)14-17(19)18-10-4-7-13-21-18/h2-3,8-9,17-19H,1,4-7,10-14H2
InChIKeyDSCWAUQYXCTQQR-UHFFFAOYSA-N
MW285.43 g/mol
LogP3.95
Rot. Bonds2

About 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine

1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine (PubChem CID 91156879) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine.

Molecular Properties

Compound Name1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine
PubChem CID91156879
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC Name1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine
SMILESc1ccc2c(c1)CC(C1CCCCO1)C2N1CCCCC1
InChIInChI=1S/C19H27NO/c1-5-11-20(12-6-1)19-16-9-3-2-8-15(16)14-17(19)18-10-4-7-13-21-18/h2-3,8-9,17-19H,1,4-7,10-14H2
InChIKeyDSCWAUQYXCTQQR-UHFFFAOYSA-N
XLogP3.95
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(9H-fluoren-9-yl)morpholine
CID 224093
(3R*,4R*)-1-(2,3-dihydro-1H-inden-2-yl)-3-methyl-4-(tetrahydro-2H-pyran-4-yl)piperidin-4-ol
CID 70712610
9-Benzyl-4-(oxolan-2-yl)-1-oxa-9-azaspiro[5.5]undecane
CID 178295436
(4S,4aS,9bR)-1,4a-dibenzyl-2,2-dimethyl-4-(trifluoromethyl)-5,9b-dihydro-4H-indeno[1,2-d][1,3]oxazine
CID 139122956
(1S)-1-[(1R,2S)-1-(dibenzylamino)-2,3-dihydro-1H-inden-2-yl]butan-1-ol
CID 134955774
1-(4-Phenyloxan-4-yl)piperidine
CID 10800408
4-fluoro-N-[2-(oxan-2-yl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 103983823
5-fluoro-N-[2-(oxan-2-yl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 104006937
10-Azatetracyclo[8.7.0.02,7.011,15]heptadeca-2,4,6-trien-16-ol
CID 20323294
3-[6-(cyclohexa-1,3-dien-1-ylmethyl)-1,4-dioxin-2-yl]-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 91215477
1-(2-Methylpropyl)-4-(9-phenyl-6-oxaspiro[4.5]decan-9-yl)piperazine
CID 132158095
4-(1-azidopropoxy)-1-(2,3-dihydro-1H-inden-1-yl)piperidine
CID 140342241

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine?
The IUPAC name of 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine (CID 91156879) is 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine.
What is the SMILES notation for 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine?
The canonical SMILES for 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine is c1ccc2c(c1)CC(C1CCCCO1)C2N1CCCCC1.
What is the InChIKey of 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine?
The InChIKey is DSCWAUQYXCTQQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-5-11-20(12-6-1)19-16-9-3-2-8-15(16)14-17(19)18-10-4-7-13-21-18/h2-3,8-9,17-19H,1,4-7,10-14H2.
What are the key properties of 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine?
1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine has a molecular weight of 285.43 g/mol, XLogP of 3.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxan-2-yl)-2,3-dihydro-1H-inden-1-yl]piperidine is sourced from PubChem (CID 91156879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).