N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide

C8H11N3O2S — CID 131165697

IUPACN-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide
SMILESO=C(NC1CCCC1O)c1csnn1
InChIInChI=1S/C8H11N3O2S/c12-7-3-1-2-5(7)9-8(13)6-4-14-11-10-6/h4-5,7,12H,1-3H2,(H,9,13)
InChIKeyOMNIBNJGMDINGD-UHFFFAOYSA-N
MW213.26 g/mol
LogP0.18
Rot. Bonds2

About N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide

N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide (PubChem CID 131165697) has the molecular formula C8H11N3O2S and a molecular weight of 213.26 g/mol. Its IUPAC name is N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide
PubChem CID131165697
Molecular FormulaC8H11N3O2S
Molecular Weight213.26 g/mol
Exact Mass213.06
IUPAC NameN-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide
SMILESO=C(NC1CCCC1O)c1csnn1
InChIInChI=1S/C8H11N3O2S/c12-7-3-1-2-5(7)9-8(13)6-4-14-11-10-6/h4-5,7,12H,1-3H2,(H,9,13)
InChIKeyOMNIBNJGMDINGD-UHFFFAOYSA-N
XLogP0.18
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.26
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide?
The IUPAC name of N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide (CID 131165697) is N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide.
What is the SMILES notation for N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide?
The canonical SMILES for N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide is O=C(NC1CCCC1O)c1csnn1.
What is the InChIKey of N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide?
The InChIKey is OMNIBNJGMDINGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2S/c12-7-3-1-2-5(7)9-8(13)6-4-14-11-10-6/h4-5,7,12H,1-3H2,(H,9,13).
What are the key properties of N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide?
N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide has a molecular weight of 213.26 g/mol, XLogP of 0.18, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide is sourced from PubChem (CID 131165697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).