N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide

C9H13N3OS — CID 65204623

IUPACN-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide
SMILESCC(C)c1nnsc1C(=O)NC1CC1
InChIInChI=1S/C9H13N3OS/c1-5(2)7-8(14-12-11-7)9(13)10-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,10,13)
InChIKeyTVMMGRMGMYPLJW-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.55
Rot. Bonds3

About N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide

N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide (PubChem CID 65204623) has the molecular formula C9H13N3OS and a molecular weight of 211.29 g/mol. Its IUPAC name is N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide
PubChem CID65204623
Molecular FormulaC9H13N3OS
Molecular Weight211.29 g/mol
Exact Mass211.08
IUPAC NameN-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide
SMILESCC(C)c1nnsc1C(=O)NC1CC1
InChIInChI=1S/C9H13N3OS/c1-5(2)7-8(14-12-11-7)9(13)10-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,10,13)
InChIKeyTVMMGRMGMYPLJW-UHFFFAOYSA-N
XLogP1.55
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-4-propan-2-ylthiadiazole-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-(2-bromocyclopentyl)-4-propan-2-ylthiadiazole-5-carboxamide
CID 80662229
N-(3-hydroxypropyl)-4-propan-2-ylthiadiazole-5-carboxamide
CID 65204185
cycloheptyl-(4-propan-2-ylthiadiazol-5-yl)methanone
CID 105125018
N-[3-[[(2-chloroacetyl)amino]methyl]-3-phenylcyclobutyl]-4-propan-2-ylthiadiazole-5-carboxamide
CID 154875703
N-[3-(methylamino)propyl]-4-propan-2-ylthiadiazole-5-carboxamide
CID 65204488
N-[4-(methylamino)cyclohexyl]-4-propylthiadiazole-5-carboxamide
CID 79110286
N-[2-(ethylamino)ethyl]-4-propan-2-ylthiadiazole-5-carboxamide
CID 65204345
N-[(2-methylpropan-2-yl)oxy]-4-propan-2-ylthiadiazole-5-carboxamide
CID 82725593
N-[2-(2-hydroxypropylamino)ethyl]-4-propan-2-ylthiadiazole-5-carboxamide
CID 113430435
N-(2-cyanoethyl)-4-propan-2-ylthiadiazole-5-carboxamide
CID 65204219
N-[(1R,5R,6S,7R)-7-(methanesulfonamido)-2-oxabicyclo[3.2.0]heptan-6-yl]-4-propan-2-ylthiadiazole-5-carboxamide
CID 91775099
N-(4-iodobutyl)-4-propan-2-ylthiadiazole-5-carboxamide
CID 106846443

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide?
The IUPAC name of N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide (CID 65204623) is N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide?
The canonical SMILES for N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide is CC(C)c1nnsc1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide?
The InChIKey is TVMMGRMGMYPLJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3OS/c1-5(2)7-8(14-12-11-7)9(13)10-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,10,13).
What are the key properties of N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide?
N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide has a molecular weight of 211.29 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-propan-2-ylthiadiazole-5-carboxamide is sourced from PubChem (CID 65204623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).