1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol

C16H24N2O2 — CID 60703871

IUPAC1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol
SMILESOC(CNC1CCc2ccccc21)CN1CCOCC1
InChIInChI=1S/C16H24N2O2/c19-14(12-18-7-9-20-10-8-18)11-17-16-6-5-13-3-1-2-4-15(13)16/h1-4,14,16-17,19H,5-12H2
InChIKeyGNZKETVBZSBDNV-UHFFFAOYSA-N
MW276.38 g/mol
LogP0.96
Rot. Bonds5

About 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol

1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol (PubChem CID 60703871) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol
PubChem CID60703871
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol
SMILESOC(CNC1CCc2ccccc21)CN1CCOCC1
InChIInChI=1S/C16H24N2O2/c19-14(12-18-7-9-20-10-8-18)11-17-16-6-5-13-3-1-2-4-15(13)16/h1-4,14,16-17,19H,5-12H2
InChIKeyGNZKETVBZSBDNV-UHFFFAOYSA-N
XLogP0.96
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol (CID 60703871) is 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol is OC(CNC1CCc2ccccc21)CN1CCOCC1.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol?
The InChIKey is GNZKETVBZSBDNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c19-14(12-18-7-9-20-10-8-18)11-17-16-6-5-13-3-1-2-4-15(13)16/h1-4,14,16-17,19H,5-12H2.
What are the key properties of 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol?
1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol has a molecular weight of 276.38 g/mol, XLogP of 0.96, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-1-ylamino)-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 60703871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).