2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide

C12H17N3OS — CID 2669903

IUPAC2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(CC1CCCC1)Nc1nnc(C2CC2)s1
InChIInChI=1S/C12H17N3OS/c16-10(7-8-3-1-2-4-8)13-12-15-14-11(17-12)9-5-6-9/h8-9H,1-7H2,(H,13,15,16)
InChIKeyNUTZGMJJNLKJNH-UHFFFAOYSA-N
MW251.35 g/mol
LogP2.93
Rot. Bonds4

About 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide

2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 2669903) has the molecular formula C12H17N3OS and a molecular weight of 251.35 g/mol. Its IUPAC name is 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide
PubChem CID2669903
Molecular FormulaC12H17N3OS
Molecular Weight251.35 g/mol
Exact Mass251.11
IUPAC Name2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(CC1CCCC1)Nc1nnc(C2CC2)s1
InChIInChI=1S/C12H17N3OS/c16-10(7-8-3-1-2-4-8)13-12-15-14-11(17-12)9-5-6-9/h8-9H,1-7H2,(H,13,15,16)
InChIKeyNUTZGMJJNLKJNH-UHFFFAOYSA-N
XLogP2.93
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.35
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide (CID 2669903) is 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide is O=C(CC1CCCC1)Nc1nnc(C2CC2)s1.
What is the InChIKey of 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is NUTZGMJJNLKJNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3OS/c16-10(7-8-3-1-2-4-8)13-12-15-14-11(17-12)9-5-6-9/h8-9H,1-7H2,(H,13,15,16).
What are the key properties of 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide?
2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 251.35 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 2669903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).