1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide

C10H15ClN4OS — CID 54985345

IUPAC1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1Cc1nnsc1Cl
InChIInChI=1S/C10H15ClN4OS/c1-12-10(16)8-4-2-3-5-15(8)6-7-9(11)17-14-13-7/h8H,2-6H2,1H3,(H,12,16)
InChIKeyCCWLPUDEDAQBKL-UHFFFAOYSA-N
MW274.78 g/mol
LogP1.29
Rot. Bonds3

About 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide

1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide (PubChem CID 54985345) has the molecular formula C10H15ClN4OS and a molecular weight of 274.78 g/mol. Its IUPAC name is 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide
PubChem CID54985345
Molecular FormulaC10H15ClN4OS
Molecular Weight274.78 g/mol
Exact Mass274.07
IUPAC Name1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1Cc1nnsc1Cl
InChIInChI=1S/C10H15ClN4OS/c1-12-10(16)8-4-2-3-5-15(8)6-7-9(11)17-14-13-7/h8H,2-6H2,1H3,(H,12,16)
InChIKeyCCWLPUDEDAQBKL-UHFFFAOYSA-N
XLogP1.29
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.78
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(5-chlorothiadiazol-4-yl)methyl-methylamino]-N-methylacetamide
CID 43408936
1-[(5-chlorothiadiazol-4-yl)methylamino]-N-(2-methylpropyl)cyclopentane-1-carboxamide
CID 71857526
(2S)-2-[(5-chlorothiadiazol-4-yl)methylamino]-3,3-dimethylbutanamide
CID 71983348
1-[(5-chlorothiadiazol-4-yl)methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 47377041
(2R)-1-[(5-chlorothiadiazol-4-yl)methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 94211103
(2S)-1-[(5-chlorothiadiazol-4-yl)methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 94211105
N-[1-[(5-chlorothiadiazol-4-yl)methyl]piperidin-4-yl]cyclopropanecarboxamide
CID 37472475
2-[4-[(5-chlorothiadiazol-4-yl)methyl]piperazin-1-yl]-N-cyclopropylacetamide
CID 16364921
2-(((5-Chloro-1,2,3-thiadiazol-4-yl)methyl)(methyl)amino)-N-propylacetamide
CID 24490933
2-[(5-chlorothiadiazol-4-yl)methyl-methylamino]-N-propan-2-ylacetamide
CID 24492306
1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-4-carboxamide
CID 24580197
2-[(5-chlorothiadiazol-4-yl)methyl-methylamino]-N-cyclopropylacetamide
CID 35886365

Frequently Asked Questions

What is the IUPAC name of 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide?
The IUPAC name of 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide (CID 54985345) is 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide?
The canonical SMILES for 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide is CNC(=O)C1CCCCN1Cc1nnsc1Cl.
What is the InChIKey of 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide?
The InChIKey is CCWLPUDEDAQBKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4OS/c1-12-10(16)8-4-2-3-5-15(8)6-7-9(11)17-14-13-7/h8H,2-6H2,1H3,(H,12,16).
What are the key properties of 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide?
1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide has a molecular weight of 274.78 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-chlorothiadiazol-4-yl)methyl]-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 54985345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).