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

C10H15N3OS — CID 977310

IUPACN-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide
SMILESCCC(=O)Nc1nnc(C2CCCC2)s1
InChIInChI=1S/C10H15N3OS/c1-2-8(14)11-10-13-12-9(15-10)7-5-3-4-6-7/h7H,2-6H2,1H3,(H,11,13,14)
InChIKeyVJPHSZFNGNXHTO-UHFFFAOYSA-N
MW225.32 g/mol
LogP2.54
Rot. Bonds3

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

N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide (PubChem CID 977310) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide
PubChem CID977310
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC NameN-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide
SMILESCCC(=O)Nc1nnc(C2CCCC2)s1
InChIInChI=1S/C10H15N3OS/c1-2-8(14)11-10-13-12-9(15-10)7-5-3-4-6-7/h7H,2-6H2,1H3,(H,11,13,14)
InChIKeyVJPHSZFNGNXHTO-UHFFFAOYSA-N
XLogP2.54
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 ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopentanecarboxamide
CID 2470137
N-(5-ethyl-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
CID 702129
N-(5-ethyl-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
CID 839902
Propionamide, N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-
CID 213280
Propionamide, N-(5-butyl-1,3,4-thiadiazol-2-yl)-
CID 3065345
N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)cyclobutanecarboxamide
CID 655064
N-(5-isopropyl-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
CID 847063
2-ethyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)butanamide
CID 741742
3-cyclohexyl-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]propanamide
CID 889545
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]cyclopentanecarboxamide
CID 8750027
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
CID 745391
N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
CID 3100928

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide?
The IUPAC name of N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide (CID 977310) is N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide.
What is the SMILES notation for N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide?
The canonical SMILES for N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide is CCC(=O)Nc1nnc(C2CCCC2)s1.
What is the InChIKey of N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide?
The InChIKey is VJPHSZFNGNXHTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-2-8(14)11-10-13-12-9(15-10)7-5-3-4-6-7/h7H,2-6H2,1H3,(H,11,13,14).
What are the key properties of N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide?
N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide has a molecular weight of 225.32 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopentyl-1,3,4-thiadiazol-2-yl)propanamide is sourced from PubChem (CID 977310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).