2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol

C15H21NO2 — CID 64803434

IUPAC2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol
SMILESOCC(COc1ccc2c(c1)CCC2)NC1CC1
InChIInChI=1S/C15H21NO2/c17-9-14(16-13-5-6-13)10-18-15-7-4-11-2-1-3-12(11)8-15/h4,7-8,13-14,16-17H,1-3,5-6,9-10H2
InChIKeySAMZLYWLUATSSI-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.67
Rot. Bonds6

About 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol

2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol (PubChem CID 64803434) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol
PubChem CID64803434
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol
SMILESOCC(COc1ccc2c(c1)CCC2)NC1CC1
InChIInChI=1S/C15H21NO2/c17-9-14(16-13-5-6-13)10-18-15-7-4-11-2-1-3-12(11)8-15/h4,7-8,13-14,16-17H,1-3,5-6,9-10H2
InChIKeySAMZLYWLUATSSI-UHFFFAOYSA-N
XLogP1.67
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-3-phenoxypropan-1-ol
CID 64804143
methyl 2-(cyclopropylamino)-4-(2,3-dihydro-1H-inden-5-yloxy)butanoate
CID 63039299
1-(2,3-dihydro-1H-inden-5-yloxy)-N-methylpentan-2-amine
CID 62043866
2-(methylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-1-ol
CID 64810805
3-(2,3-dihydro-1H-inden-5-yloxy)-2-methyl-N-propan-2-ylpropan-1-amine
CID 62459279
N-[3-(2,3-dihydro-1H-inden-5-yloxy)propyl]cyclopropanamine
CID 29015190
1-cyclohexyl-N-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethanamine
CID 104749235
1-(2,3-dihydro-1H-inden-5-yloxy)-N-ethyl-3-methoxypropan-2-amine
CID 107506688
2-(cyclopropylamino)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
CID 82289327
N-ethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-2-amine
CID 62038734
1-(2,3-dihydro-1H-inden-5-yloxy)propan-2-ylhydrazine
CID 82283353
N-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]cycloheptanamine
CID 63516362

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol (CID 64803434) is 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol is OCC(COc1ccc2c(c1)CCC2)NC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol?
The InChIKey is SAMZLYWLUATSSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c17-9-14(16-13-5-6-13)10-18-15-7-4-11-2-1-3-12(11)8-15/h4,7-8,13-14,16-17H,1-3,5-6,9-10H2.
What are the key properties of 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol?
2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol has a molecular weight of 247.34 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3-(2,3-dihydro-1H-inden-5-yloxy)propan-1-ol is sourced from PubChem (CID 64803434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).