1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol

C10H17N3O2S — CID 60904172

IUPAC1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
SMILESOC(CNC1CCCC1)COc1cnsn1
InChIInChI=1S/C10H17N3O2S/c14-9(5-11-8-3-1-2-4-8)7-15-10-6-12-16-13-10/h6,8-9,11,14H,1-5,7H2
InChIKeyOZJNEHJWVNEDMG-UHFFFAOYSA-N
MW243.33 g/mol
LogP0.81
Rot. Bonds6

About 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol

1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol (PubChem CID 60904172) has the molecular formula C10H17N3O2S and a molecular weight of 243.33 g/mol. Its IUPAC name is 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol.

Molecular Properties

Compound Name1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
PubChem CID60904172
Molecular FormulaC10H17N3O2S
Molecular Weight243.33 g/mol
Exact Mass243.10
IUPAC Name1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
SMILESOC(CNC1CCCC1)COc1cnsn1
InChIInChI=1S/C10H17N3O2S/c14-9(5-11-8-3-1-2-4-8)7-15-10-6-12-16-13-10/h6,8-9,11,14H,1-5,7H2
InChIKeyOZJNEHJWVNEDMG-UHFFFAOYSA-N
XLogP0.81
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-[(1-methylpiperidin-4-yl)amino]-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 60909284
1-[(2-methylcyclohexyl)amino]-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 60897023
1-[[(1S)-1-cyclopentylethyl]amino]-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 81396146
1-(2,3-dihydro-1H-inden-2-ylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 107852038
1-(2-cyclopentylethylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 54932742
1-[(2,6-dimethylpiperidin-1-yl)amino]-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 83021124
1-[(2-methoxycyclopentyl)amino]-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 55033364
1-[(2,2-diethyloxan-4-yl)amino]-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 83036263
1-(2-cyclopropylpropan-2-ylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 104577999
1-[(1,3-dimethylpiperidin-4-yl)amino]-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 114503518
3-[[[2-hydroxy-3-(1,2,5-thiadiazol-3-yloxy)propyl]amino]methyl]cyclopentan-1-ol
CID 106130149
1-(oxan-3-ylmethylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 54906125

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol?
The IUPAC name of 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol (CID 60904172) is 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol.
What is the SMILES notation for 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol?
The canonical SMILES for 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol is OC(CNC1CCCC1)COc1cnsn1.
What is the InChIKey of 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol?
The InChIKey is OZJNEHJWVNEDMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S/c14-9(5-11-8-3-1-2-4-8)7-15-10-6-12-16-13-10/h6,8-9,11,14H,1-5,7H2.
What are the key properties of 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol?
1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol has a molecular weight of 243.33 g/mol, XLogP of 0.81, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol is sourced from PubChem (CID 60904172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).