1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol

C17H27NO2 — CID 62306417

IUPAC1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol
SMILESCCC(NCC(O)COC1CCCC1)c1ccccc1
InChIInChI=1S/C17H27NO2/c1-2-17(14-8-4-3-5-9-14)18-12-15(19)13-20-16-10-6-7-11-16/h3-5,8-9,15-19H,2,6-7,10-13H2,1H3
InChIKeyNPTIELCXSARWNX-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.05
Rot. Bonds8

About 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol

1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol (PubChem CID 62306417) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol
PubChem CID62306417
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol
SMILESCCC(NCC(O)COC1CCCC1)c1ccccc1
InChIInChI=1S/C17H27NO2/c1-2-17(14-8-4-3-5-9-14)18-12-15(19)13-20-16-10-6-7-11-16/h3-5,8-9,15-19H,2,6-7,10-13H2,1H3
InChIKeyNPTIELCXSARWNX-UHFFFAOYSA-N
XLogP3.05
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol
CID 55251514
1-cyclopentyloxy-3-(2-phenylpropylamino)propan-2-ol
CID 104591392
1-(1-phenylpropylamino)butan-2-ol
CID 62305218
1-(4-methylpentoxy)-3-(1-phenylpropylamino)propan-2-ol
CID 62303856
1-[(2-methylpropan-2-yl)oxy]-3-(1-phenylpropylamino)propan-2-ol
CID 62306251
1-cyclohexyloxy-3-[[(1S)-1-pyridin-3-ylethyl]amino]propan-2-ol
CID 81404417
N-cyclopentyloxy-1-phenylpropan-1-amine
CID 83228943
1-cyclohexyloxy-3-[[(1R)-1-pyridin-4-ylethyl]amino]propan-2-ol
CID 81409866
1-cyclopentyloxy-3-(2-methylsulfanylanilino)propan-2-ol
CID 107644598
1-cyclopentyloxy-3-(1-thiophen-3-ylethylamino)propan-2-ol
CID 62840331
1-(2-methylcyclohexyl)oxy-3-[[(1R)-1-phenylethyl]amino]propan-2-ol
CID 63867829
1-cyclopentyloxy-3-(3-methylanilino)propan-2-ol
CID 60902650

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol?
The IUPAC name of 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol (CID 62306417) is 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol.
What is the SMILES notation for 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol?
The canonical SMILES for 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol is CCC(NCC(O)COC1CCCC1)c1ccccc1.
What is the InChIKey of 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol?
The InChIKey is NPTIELCXSARWNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-2-17(14-8-4-3-5-9-14)18-12-15(19)13-20-16-10-6-7-11-16/h3-5,8-9,15-19H,2,6-7,10-13H2,1H3.
What are the key properties of 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol?
1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol has a molecular weight of 277.41 g/mol, XLogP of 3.05, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol is sourced from PubChem (CID 62306417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).