5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide

C10H17N5OS — CID 105420364

IUPAC5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide
SMILESCN(C)C1(CNC(=O)c2nnc(N)s2)CCC1
InChIInChI=1S/C10H17N5OS/c1-15(2)10(4-3-5-10)6-12-7(16)8-13-14-9(11)17-8/h3-6H2,1-2H3,(H2,11,14)(H,12,16)
InChIKeyBCSFLKUVWGGACU-UHFFFAOYSA-N
MW255.35 g/mol
LogP0.33
Rot. Bonds4

About 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide

5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide (PubChem CID 105420364) has the molecular formula C10H17N5OS and a molecular weight of 255.35 g/mol. Its IUPAC name is 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide
PubChem CID105420364
Molecular FormulaC10H17N5OS
Molecular Weight255.35 g/mol
Exact Mass255.12
IUPAC Name5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide
SMILESCN(C)C1(CNC(=O)c2nnc(N)s2)CCC1
InChIInChI=1S/C10H17N5OS/c1-15(2)10(4-3-5-10)6-12-7(16)8-13-14-9(11)17-8/h3-6H2,1-2H3,(H2,11,14)(H,12,16)
InChIKeyBCSFLKUVWGGACU-UHFFFAOYSA-N
XLogP0.33
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 ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-N-[(1-methylpiperidin-3-yl)methyl]-1,3,4-thiadiazole-2-carboxamide
CID 80614893
5-amino-N-(1-ethylpiperidin-3-yl)-1,3,4-thiadiazole-2-carboxamide
CID 80614894
5-(methylamino)-N-(2-methylbutan-2-yl)-1,3,4-thiadiazole-2-carboxamide
CID 80614897
5-amino-N,N-dipropyl-1,3,4-thiadiazole-2-carboxamide
CID 80614904
5-amino-N-cycloheptyl-N-methyl-1,3,4-thiadiazole-2-carboxamide
CID 80614947
5-amino-N,N-bis(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide
CID 80614958
5-amino-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-1,3,4-thiadiazole-2-carboxamide
CID 80614970
5-amino-N-octan-2-yl-1,3,4-thiadiazole-2-carboxamide
CID 80614975
5-(methylamino)-N,N-dipropyl-1,3,4-thiadiazole-2-carboxamide
CID 80614991
5-amino-N-hexan-3-yl-1,3,4-thiadiazole-2-carboxamide
CID 80615042
5-(methylamino)-N,N-bis(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide
CID 80615047
5-amino-N-(1-methylpiperidin-4-yl)-1,3,4-thiadiazole-2-carboxamide
CID 80615107

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide?
The IUPAC name of 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide (CID 105420364) is 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide.
What is the SMILES notation for 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide?
The canonical SMILES for 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide is CN(C)C1(CNC(=O)c2nnc(N)s2)CCC1.
What is the InChIKey of 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide?
The InChIKey is BCSFLKUVWGGACU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5OS/c1-15(2)10(4-3-5-10)6-12-7(16)8-13-14-9(11)17-8/h3-6H2,1-2H3,(H2,11,14)(H,12,16).
What are the key properties of 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide?
5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide has a molecular weight of 255.35 g/mol, XLogP of 0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,4-thiadiazole-2-carboxamide is sourced from PubChem (CID 105420364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).