1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide

C10H17N5OS — CID 62177869

IUPAC1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide
SMILESCNc1snnc1CN1CCC(C(N)=O)CC1
InChIInChI=1S/C10H17N5OS/c1-12-10-8(13-14-17-10)6-15-4-2-7(3-5-15)9(11)16/h7,12H,2-6H2,1H3,(H2,11,16)
InChIKeyJASAJVAWCZCWSP-UHFFFAOYSA-N
MW255.35 g/mol
LogP0.28
Rot. Bonds4

About 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide

1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide (PubChem CID 62177869) has the molecular formula C10H17N5OS and a molecular weight of 255.35 g/mol. Its IUPAC name is 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide
PubChem CID62177869
Molecular FormulaC10H17N5OS
Molecular Weight255.35 g/mol
Exact Mass255.12
IUPAC Name1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide
SMILESCNc1snnc1CN1CCC(C(N)=O)CC1
InChIInChI=1S/C10H17N5OS/c1-12-10-8(13-14-17-10)6-15-4-2-7(3-5-15)9(11)16/h7,12H,2-6H2,1H3,(H2,11,16)
InChIKeyJASAJVAWCZCWSP-UHFFFAOYSA-N
XLogP0.28
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.35
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide?
The IUPAC name of 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide (CID 62177869) is 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide is CNc1snnc1CN1CCC(C(N)=O)CC1.
What is the InChIKey of 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide?
The InChIKey is JASAJVAWCZCWSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5OS/c1-12-10-8(13-14-17-10)6-15-4-2-7(3-5-15)9(11)16/h7,12H,2-6H2,1H3,(H2,11,16).
What are the key properties of 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide?
1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide has a molecular weight of 255.35 g/mol, XLogP of 0.28, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidine-4-carboxamide is sourced from PubChem (CID 62177869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).