1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol

C15H25NO2S — CID 63291900

IUPAC1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol
SMILESCC(Cc1cccs1)NCC(O)COC1CCCC1
InChIInChI=1S/C15H25NO2S/c1-12(9-15-7-4-8-19-15)16-10-13(17)11-18-14-5-2-3-6-14/h4,7-8,12-14,16-17H,2-3,5-6,9-11H2,1H3
InChIKeySWKQCDNLKKDFDN-UHFFFAOYSA-N
MW283.44 g/mol
LogP2.59
Rot. Bonds8

About 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol

1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol (PubChem CID 63291900) has the molecular formula C15H25NO2S and a molecular weight of 283.44 g/mol. Its IUPAC name is 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol
PubChem CID63291900
Molecular FormulaC15H25NO2S
Molecular Weight283.44 g/mol
Exact Mass283.16
IUPAC Name1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol
SMILESCC(Cc1cccs1)NCC(O)COC1CCCC1
InChIInChI=1S/C15H25NO2S/c1-12(9-15-7-4-8-19-15)16-10-13(17)11-18-14-5-2-3-6-14/h4,7-8,12-14,16-17H,2-3,5-6,9-11H2,1H3
InChIKeySWKQCDNLKKDFDN-UHFFFAOYSA-N
XLogP2.59
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol
CID 103157774
1-(dimethylamino)-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol
CID 63291858
1-cyclopentyloxy-3-[[(1S)-1-phenylethyl]amino]propan-2-ol
CID 55251514
1-(1,2,5-thiadiazol-3-yloxy)-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol
CID 63291899
1-cyclopentyloxy-3-(1-thiophen-3-ylethylamino)propan-2-ol
CID 62840331
3-[(3-cyclohexyloxy-2-hydroxypropyl)amino]butan-1-ol
CID 83178126
1-cyclohexyloxy-3-[[(1R)-1-pyridin-4-ylethyl]amino]propan-2-ol
CID 81409866
1-(2-methylcyclohexyl)oxy-3-(thiophen-2-ylmethylamino)propan-2-ol
CID 60633182
1-cyclopentyloxy-3-[4-(dimethylamino)butan-2-ylamino]propan-2-ol
CID 54963637
1-cyclohexyloxy-3-(hexan-2-ylamino)propan-2-ol
CID 55049964
1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol
CID 62306417
1-(pentan-2-ylamino)-3-(thiophen-2-ylmethoxy)propan-2-ol
CID 60634664

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol?
The IUPAC name of 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol (CID 63291900) is 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol.
What is the SMILES notation for 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol?
The canonical SMILES for 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol is CC(Cc1cccs1)NCC(O)COC1CCCC1.
What is the InChIKey of 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol?
The InChIKey is SWKQCDNLKKDFDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2S/c1-12(9-15-7-4-8-19-15)16-10-13(17)11-18-14-5-2-3-6-14/h4,7-8,12-14,16-17H,2-3,5-6,9-11H2,1H3.
What are the key properties of 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol?
1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol has a molecular weight of 283.44 g/mol, XLogP of 2.59, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyloxy-3-(1-thiophen-2-ylpropan-2-ylamino)propan-2-ol is sourced from PubChem (CID 63291900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).