N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide

C10H16N4OS — CID 106609110

IUPACN-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide
SMILESCCN(CC1CCCN1)C(=O)c1cnns1
InChIInChI=1S/C10H16N4OS/c1-2-14(7-8-4-3-5-11-8)10(15)9-6-12-13-16-9/h6,8,11H,2-5,7H2,1H3
InChIKeyZZGKOUDNHXSLCK-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.75
Rot. Bonds4

About N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide

N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide (PubChem CID 106609110) has the molecular formula C10H16N4OS and a molecular weight of 240.33 g/mol. Its IUPAC name is N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide
PubChem CID106609110
Molecular FormulaC10H16N4OS
Molecular Weight240.33 g/mol
Exact Mass240.10
IUPAC NameN-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide
SMILESCCN(CC1CCCN1)C(=O)c1cnns1
InChIInChI=1S/C10H16N4OS/c1-2-14(7-8-4-3-5-11-8)10(15)9-6-12-13-16-9/h6,8,11H,2-5,7H2,1H3
InChIKeyZZGKOUDNHXSLCK-UHFFFAOYSA-N
XLogP0.75
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-ethyl-N-(pyrrolidin-2-ylmethyl)pyridine-2-carboxamide
CID 106609136
N-ethyl-4-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609417
N-ethyl-4-fluoro-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609422
N-ethyl-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 106608884
N-ethyl-N-(piperidin-2-ylmethyl)-4-propylthiadiazole-5-carboxamide
CID 106626170
4-chloro-N-ethyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609166
4,5-dichloro-N-ethyl-N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-2-carboxamide
CID 106608927
3-bromo-N-ethyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide
CID 106609503
N-ethyl-N-(piperidin-2-ylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 106626265
4-tert-butyl-N-ethyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609044
N-ethyl-N-(pyrrolidin-2-ylmethyl)quinoxaline-2-carboxamide
CID 107356560
4-cyano-N-ethyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609443

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide?
The IUPAC name of N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide (CID 106609110) is N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide.
What is the SMILES notation for N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide?
The canonical SMILES for N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide is CCN(CC1CCCN1)C(=O)c1cnns1.
What is the InChIKey of N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide?
The InChIKey is ZZGKOUDNHXSLCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4OS/c1-2-14(7-8-4-3-5-11-8)10(15)9-6-12-13-16-9/h6,8,11H,2-5,7H2,1H3.
What are the key properties of N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide?
N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide has a molecular weight of 240.33 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide is sourced from PubChem (CID 106609110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).