N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide

C8H14N4OS — CID 23111173

IUPACN-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide
SMILESCc1nnsc1C(=O)NCC(C)(C)N
InChIInChI=1S/C8H14N4OS/c1-5-6(14-12-11-5)7(13)10-4-8(2,3)9/h4,9H2,1-3H3,(H,10,13)
InChIKeySRKCEAOQSSFOTH-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.31
Rot. Bonds3

About N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide

N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide (PubChem CID 23111173) has the molecular formula C8H14N4OS and a molecular weight of 214.29 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide
PubChem CID23111173
Molecular FormulaC8H14N4OS
Molecular Weight214.29 g/mol
Exact Mass214.09
IUPAC NameN-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide
SMILESCc1nnsc1C(=O)NCC(C)(C)N
InChIInChI=1S/C8H14N4OS/c1-5-6(14-12-11-5)7(13)10-4-8(2,3)9/h4,9H2,1-3H3,(H,10,13)
InChIKeySRKCEAOQSSFOTH-UHFFFAOYSA-N
XLogP0.31
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-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

N-cyclohexyl-4-methyl-1,2,3-thiadiazole-5-carboxamide
CID 2804319
N-cycloheptyl-4-methylthiadiazole-5-carboxamide
CID 4825736
N-cyclooctyl-4-methyl-1,2,3-thiadiazole-5-carboxamide
CID 20383908
4-methyl-N-[2-[(4-methylthiadiazole-5-carbonyl)amino]ethyl]thiadiazole-5-carboxamide
CID 2740849
4-methyl-N-(2-methylbut-3-yn-2-yl)thiadiazole-5-carboxamide
CID 2804291
4-[(4-Methyl-1,2,3-thiadiazol-5-yl)carbonyl]piperazinecarbaldehyde
CID 7293413
4-methyl-N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]thiadiazole-5-carboxamide
CID 45505517
4-methyl-N-(2,2,2-trifluoroethyl)-1,2,3-thiadiazole-5-carboxamide
CID 45497137
N-({(2S,4S)-4-fluoro-1-[(4-methyl-1,2,3-thiadiazol-5-yl)carbonyl]pyrrolidin-2-yl}methyl)-3,3-dimethylbutanamide
CID 70758685
N-[3-(diethylamino)-3-oxopropyl]-4-methylthiadiazole-5-carboxamide
CID 91651649
4-methyl-N-[[(3R)-1-(2-methylpropyl)piperidin-3-yl]methyl]thiadiazole-5-carboxamide
CID 95209726
N-[2-[[2-[(2R,4S)-4-fluoro-2-isocyanopyrrolidin-1-yl]-2-oxoethyl]amino]-2-methylpropyl]-4-methylthiadiazole-5-carboxamide
CID 58774338

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide (CID 23111173) is N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide is Cc1nnsc1C(=O)NCC(C)(C)N.
What is the InChIKey of N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide?
The InChIKey is SRKCEAOQSSFOTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4OS/c1-5-6(14-12-11-5)7(13)10-4-8(2,3)9/h4,9H2,1-3H3,(H,10,13).
What are the key properties of N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide?
N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide has a molecular weight of 214.29 g/mol, XLogP of 0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-4-methylthiadiazole-5-carboxamide is sourced from PubChem (CID 23111173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).