N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide

C10H7Cl2N3OS — CID 64593204

IUPACN-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide
SMILESO=C(Nc1c(Cl)cc(Cl)c2nsnc12)C1CC1
InChIInChI=1S/C10H7Cl2N3OS/c11-5-3-6(12)8-9(15-17-14-8)7(5)13-10(16)4-1-2-4/h3-4H,1-2H2,(H,13,16)
InChIKeyLPOLKJVHQDOCFJ-UHFFFAOYSA-N
MW288.16 g/mol
LogP3.35
Rot. Bonds2

About N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide

N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide (PubChem CID 64593204) has the molecular formula C10H7Cl2N3OS and a molecular weight of 288.16 g/mol. Its IUPAC name is N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide
PubChem CID64593204
Molecular FormulaC10H7Cl2N3OS
Molecular Weight288.16 g/mol
Exact Mass286.97
IUPAC NameN-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide
SMILESO=C(Nc1c(Cl)cc(Cl)c2nsnc12)C1CC1
InChIInChI=1S/C10H7Cl2N3OS/c11-5-3-6(12)8-9(15-17-14-8)7(5)13-10(16)4-1-2-4/h3-4H,1-2H2,(H,13,16)
InChIKeyLPOLKJVHQDOCFJ-UHFFFAOYSA-N
XLogP3.35
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.16
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)-6-oxopiperidine-3-carboxamide
CID 76896736
2-(cyclopropylmethylamino)-N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)acetamide
CID 60866735
1-amino-N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopentane-1-carboxamide
CID 60852266
N-(2,6-dichloro-4-fluorophenyl)cyclopropanecarboxamide
CID 82889777
4-bromo-N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)benzamide
CID 60955307
5,7-dichloro-N-methyl-2,1,3-benzothiadiazol-4-amine
CID 63090384
4-amino-N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)-5-methylthiophene-2-carboxamide
CID 65474030
N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)-4-(propan-2-ylamino)butanamide
CID 60851320
2-(4-aminopyrazol-1-yl)-N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)acetamide
CID 65474419
3-[(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)amino]-2-methylpropanamide
CID 65474663
2-[(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)sulfamoyl]propanoic acid
CID 61455279
3-amino-N-(5-chloro-2,1,3-benzothiadiazol-4-yl)bicyclo[2.2.1]heptane-2-carboxamide
CID 65475498

Frequently Asked Questions

What is the IUPAC name of N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide?
The IUPAC name of N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide (CID 64593204) is N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide is O=C(Nc1c(Cl)cc(Cl)c2nsnc12)C1CC1.
What is the InChIKey of N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide?
The InChIKey is LPOLKJVHQDOCFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Cl2N3OS/c11-5-3-6(12)8-9(15-17-14-8)7(5)13-10(16)4-1-2-4/h3-4H,1-2H2,(H,13,16).
What are the key properties of N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide?
N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide has a molecular weight of 288.16 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)cyclopropanecarboxamide is sourced from PubChem (CID 64593204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).