N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide

C6H7N3OS — CID 60858227

IUPACN-cyclopropyl-1,2,5-thiadiazole-3-carboxamide
SMILESO=C(NC1CC1)c1cnsn1
InChIInChI=1S/C6H7N3OS/c10-6(8-4-1-2-4)5-3-7-11-9-5/h3-4H,1-2H2,(H,8,10)
InChIKeyIMZDVFQZJSGYFW-UHFFFAOYSA-N
MW169.21 g/mol
LogP0.43
Rot. Bonds2

About N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide

N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide (PubChem CID 60858227) has the molecular formula C6H7N3OS and a molecular weight of 169.21 g/mol. Its IUPAC name is N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1,2,5-thiadiazole-3-carboxamide
PubChem CID60858227
Molecular FormulaC6H7N3OS
Molecular Weight169.21 g/mol
Exact Mass169.03
IUPAC NameN-cyclopropyl-1,2,5-thiadiazole-3-carboxamide
SMILESO=C(NC1CC1)c1cnsn1
InChIInChI=1S/C6H7N3OS/c10-6(8-4-1-2-4)5-3-7-11-9-5/h3-4H,1-2H2,(H,8,10)
InChIKeyIMZDVFQZJSGYFW-UHFFFAOYSA-N
XLogP0.43
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.21
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1,2,5-thiadiazole-3-carbonylamino)cyclohexane-1-carboxylic acid
CID 60807914
cis-(1S,3R)-3-(1,2,5-thiadiazole-3-carbonylamino)cyclopentane-1-carboxylic acid
CID 120675557
N-[(3R)-pyrrolidin-3-yl]-1,2,5-thiadiazole-3-carboxamide
CID 79685297
N-(1-azaspiro[5.5]undecan-4-yl)-1,2,5-thiadiazole-3-carboxamide
CID 43595660
N-[(3S)-1-(1-methylpyrazol-4-yl)piperidin-3-yl]-1,2,5-thiadiazole-3-carboxamide
CID 124590300
N-(2-cyclohexylethyl)-1,2,5-thiadiazole-3-carboxamide
CID 47338961
N-(2-pyrrolidin-3-ylethyl)-1,2,5-thiadiazole-3-carboxamide
CID 63630234
1,2,5-thiadiazole-3-carboxylic acid
CID 1398314
N-[(4-hydroxypyrrolidin-3-yl)methyl]-1,2,5-thiadiazole-3-carboxamide
CID 120945116
N-cyclopropyl-1,2-thiazole-5-carboxamide
CID 110692070
4-methyl-1-[(1,2,5-thiadiazole-3-carbonylamino)methyl]cyclohexane-1-carboxylic acid
CID 113310364
N-(2-chloroprop-2-enyl)-1,2,5-thiadiazole-3-carboxamide
CID 115636693

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide (CID 60858227) is N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide is O=C(NC1CC1)c1cnsn1.
What is the InChIKey of N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide?
The InChIKey is IMZDVFQZJSGYFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3OS/c10-6(8-4-1-2-4)5-3-7-11-9-5/h3-4H,1-2H2,(H,8,10).
What are the key properties of N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide?
N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide has a molecular weight of 169.21 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1,2,5-thiadiazole-3-carboxamide is sourced from PubChem (CID 60858227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).