1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol

C16H25NO2 — CID 55251514

IUPAC1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol
SMILESC[C@H](NCC(O)COC1CCCC1)c1ccccc1
InChIInChI=1S/C16H25NO2/c1-13(14-7-3-2-4-8-14)17-11-15(18)12-19-16-9-5-6-10-16/h2-4,7-8,13,15-18H,5-6,9-12H2,1H3/t13-,15?/m0/s1
InChIKeyLCPIGSDGECIIBR-CFMCSPIPSA-N
MW263.38 g/mol
LogP2.66
Rot. Bonds7

About 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol

1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol (PubChem CID 55251514) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol
PubChem CID55251514
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol
SMILESC[C@H](NCC(O)COC1CCCC1)c1ccccc1
InChIInChI=1S/C16H25NO2/c1-13(14-7-3-2-4-8-14)17-11-15(18)12-19-16-9-5-6-10-16/h2-4,7-8,13,15-18H,5-6,9-12H2,1H3/t13-,15?/m0/s1
InChIKeyLCPIGSDGECIIBR-CFMCSPIPSA-N
XLogP2.66
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol with MolForge

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Related Compounds

1-cyclohexyloxy-3-[[(1R)-1-pyridin-4-ylethyl]amino]propan-2-ol
CID 81409866
1-(2-methylcyclohexyl)oxy-3-[[(1R)-1-phenylethyl]amino]propan-2-ol
CID 63867829
1-cyclohexyloxy-3-[[(1S)-1-pyridin-3-ylethyl]amino]propan-2-ol
CID 81404417
1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol
CID 62306417
1-cyclopentyloxy-3-(2-phenylpropylamino)propan-2-ol
CID 104591392
1-cyclopentyloxy-3-(1-thiophen-3-ylethylamino)propan-2-ol
CID 62840331
1-methoxy-3-[[(1R)-1-phenylethyl]amino]propan-2-ol
CID 78953875
1,3-bis[[(1S)-1-phenylethyl]amino]propan-2-ol
CID 15470316
1-(4-methylcyclohexyl)oxy-3-[[(1S)-1-pyridin-4-ylethyl]amino]propan-2-ol
CID 81393883
1-ethoxy-3-[[(1R)-1-phenylethyl]amino]propan-2-ol
CID 78954638
1-[1-(5-chlorothiophen-2-yl)ethylamino]-3-cyclohexyloxypropan-2-ol
CID 61469543
(2R)-1-[(2-methylpropan-2-yl)oxy]-3-[[(1R)-1-phenylethyl]amino]propan-2-ol
CID 8741564

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol?
The IUPAC name of 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol (CID 55251514) is 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol.
What is the SMILES notation for 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol?
The canonical SMILES for 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol is C[C@H](NCC(O)COC1CCCC1)c1ccccc1.
What is the InChIKey of 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol?
The InChIKey is LCPIGSDGECIIBR-CFMCSPIPSA-N. The full InChI is InChI=1S/C16H25NO2/c1-13(14-7-3-2-4-8-14)17-11-15(18)12-19-16-9-5-6-10-16/h2-4,7-8,13,15-18H,5-6,9-12H2,1H3/t13-,15?/m0/s1.
What are the key properties of 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol?
1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol has a molecular weight of 263.38 g/mol, XLogP of 2.66, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol is sourced from PubChem (CID 55251514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).