N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide

C12H18N4OS — CID 163345339

IUPACN-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide
SMILESCc1nsc(N2CCC(C(=O)NC3CC3)CC2)n1
InChIInChI=1S/C12H18N4OS/c1-8-13-12(18-15-8)16-6-4-9(5-7-16)11(17)14-10-2-3-10/h9-10H,2-7H2,1H3,(H,14,17)
InChIKeyKUSCXDBMXYYYJT-UHFFFAOYSA-N
MW266.37 g/mol
LogP1.34
Rot. Bonds3

About N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide

N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide (PubChem CID 163345339) has the molecular formula C12H18N4OS and a molecular weight of 266.37 g/mol. Its IUPAC name is N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide
PubChem CID163345339
Molecular FormulaC12H18N4OS
Molecular Weight266.37 g/mol
Exact Mass266.12
IUPAC NameN-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide
SMILESCc1nsc(N2CCC(C(=O)NC3CC3)CC2)n1
InChIInChI=1S/C12H18N4OS/c1-8-13-12(18-15-8)16-6-4-9(5-7-16)11(17)14-10-2-3-10/h9-10H,2-7H2,1H3,(H,14,17)
InChIKeyKUSCXDBMXYYYJT-UHFFFAOYSA-N
XLogP1.34
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methanone
CID 171992743
5-(4-chloroazepan-1-yl)-3-methyl-1,2,4-thiadiazole
CID 127004433
N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]pyrimidine-4-carboxamide
CID 175648747
N-cyclopropyl-1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-4-carboxamide
CID 5027741
tert-butyl N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)pyrrolidin-3-yl]carbamate
CID 133320499
1-[4-(3-methyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]ethanone
CID 133328044
1-(3-methyl-1,2,4-thiadiazol-5-yl)-N,N-di(propan-2-yl)piperidin-4-amine
CID 59598889
1-methyl-3-[1-(3-methyl-1,2,4-thiadiazol-5-yl)azetidin-3-yl]urea
CID 136540782
N-cyclopropyl-1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 163348930
5-[4-(fluoromethyl)piperidin-1-yl]-3-methyl-1,2,4-thiadiazole
CID 126790732
[1-(3-methyl-1,2,4-thiadiazol-5-yl)azetidin-3-yl]-pyrrolidin-1-ylmethanone
CID 165434757
cycloheptyl-[4-(3-methyl-1,2,4-thiadiazol-5-yl)-1,4-diazepan-1-yl]methanone
CID 71926251

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide?
The IUPAC name of N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide (CID 163345339) is N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide is Cc1nsc(N2CCC(C(=O)NC3CC3)CC2)n1.
What is the InChIKey of N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide?
The InChIKey is KUSCXDBMXYYYJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4OS/c1-8-13-12(18-15-8)16-6-4-9(5-7-16)11(17)14-10-2-3-10/h9-10H,2-7H2,1H3,(H,14,17).
What are the key properties of N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide?
N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide has a molecular weight of 266.37 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-4-carboxamide is sourced from PubChem (CID 163345339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).