2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol

C9H15N3OS — CID 131146767

IUPAC2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol
SMILESCC(NC1CCCC1O)c1csnn1
InChIInChI=1S/C9H15N3OS/c1-6(8-5-14-12-11-8)10-7-3-2-4-9(7)13/h5-7,9-10,13H,2-4H2,1H3
InChIKeyWHNAKUPZRFJPQG-UHFFFAOYSA-N
MW213.31 g/mol
LogP1.10
Rot. Bonds3

About 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol

2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol (PubChem CID 131146767) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol
PubChem CID131146767
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC Name2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol
SMILESCC(NC1CCCC1O)c1csnn1
InChIInChI=1S/C9H15N3OS/c1-6(8-5-14-12-11-8)10-7-3-2-4-9(7)13/h5-7,9-10,13H,2-4H2,1H3
InChIKeyWHNAKUPZRFJPQG-UHFFFAOYSA-N
XLogP1.10
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol?
The IUPAC name of 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol (CID 131146767) is 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol.
What is the SMILES notation for 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol?
The canonical SMILES for 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol is CC(NC1CCCC1O)c1csnn1.
What is the InChIKey of 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol?
The InChIKey is WHNAKUPZRFJPQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c1-6(8-5-14-12-11-8)10-7-3-2-4-9(7)13/h5-7,9-10,13H,2-4H2,1H3.
What are the key properties of 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol?
2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol has a molecular weight of 213.31 g/mol, XLogP of 1.10, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(thiadiazol-4-yl)ethylamino]cyclopentan-1-ol is sourced from PubChem (CID 131146767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).