N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide

C10H15N3OS — CID 1247323

IUPACN-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide
SMILESCC(=O)Nc1nnc(CC2CCCC2)s1
InChIInChI=1S/C10H15N3OS/c1-7(14)11-10-13-12-9(15-10)6-8-4-2-3-5-8/h8H,2-6H2,1H3,(H,11,13,14)
InChIKeyRZEZJFLWMAFGOG-UHFFFAOYSA-N
MW225.32 g/mol
LogP2.23
Rot. Bonds3

About N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide

N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide (PubChem CID 1247323) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide
PubChem CID1247323
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC NameN-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide
SMILESCC(=O)Nc1nnc(CC2CCCC2)s1
InChIInChI=1S/C10H15N3OS/c1-7(14)11-10-13-12-9(15-10)6-8-4-2-3-5-8/h8H,2-6H2,1H3,(H,11,13,14)
InChIKeyRZEZJFLWMAFGOG-UHFFFAOYSA-N
XLogP2.23
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide?
The IUPAC name of N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide (CID 1247323) is N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide?
The canonical SMILES for N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide is CC(=O)Nc1nnc(CC2CCCC2)s1.
What is the InChIKey of N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide?
The InChIKey is RZEZJFLWMAFGOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-7(14)11-10-13-12-9(15-10)6-8-4-2-3-5-8/h8H,2-6H2,1H3,(H,11,13,14).
What are the key properties of N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide?
N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide has a molecular weight of 225.32 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(cyclopentylmethyl)-1,3,4-thiadiazol-2-yl]acetamide is sourced from PubChem (CID 1247323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).