N-(2-aminocycloheptyl)thiadiazole-4-carboxamide

C10H16N4OS — CID 65216552

IUPACN-(2-aminocycloheptyl)thiadiazole-4-carboxamide
SMILESNC1CCCCCC1NC(=O)c1csnn1
InChIInChI=1S/C10H16N4OS/c11-7-4-2-1-3-5-8(7)12-10(15)9-6-16-14-13-9/h6-8H,1-5,11H2,(H,12,15)
InChIKeyKQCNBRKMAYSJDB-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.93
Rot. Bonds2

About N-(2-aminocycloheptyl)thiadiazole-4-carboxamide

N-(2-aminocycloheptyl)thiadiazole-4-carboxamide (PubChem CID 65216552) has the molecular formula C10H16N4OS and a molecular weight of 240.33 g/mol. Its IUPAC name is N-(2-aminocycloheptyl)thiadiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-aminocycloheptyl)thiadiazole-4-carboxamide
PubChem CID65216552
Molecular FormulaC10H16N4OS
Molecular Weight240.33 g/mol
Exact Mass240.10
IUPAC NameN-(2-aminocycloheptyl)thiadiazole-4-carboxamide
SMILESNC1CCCCCC1NC(=O)c1csnn1
InChIInChI=1S/C10H16N4OS/c11-7-4-2-1-3-5-8(7)12-10(15)9-6-16-14-13-9/h6-8H,1-5,11H2,(H,12,15)
InChIKeyKQCNBRKMAYSJDB-UHFFFAOYSA-N
XLogP0.93
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-hydroxycyclopentyl)thiadiazole-4-carboxamide
CID 131165697
N-(2-aminocycloheptyl)-4-methylthiadiazole-5-carboxamide
CID 63258149
N-[(1S,2R)-2-aminocyclohexyl]benzamide
CID 15151854
N-[(1S,2S)-2-aminocyclohexyl]benzamide
CID 15151853
N-(2-aminocycloheptyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 114909182
N-(2-aminocyclopentyl)quinoline-2-carboxamide
CID 63251270
N-(2-aminocycloheptyl)-4-chlorobenzamide
CID 63258248
N-(2-aminocyclohexyl)-2,6-dichlorobenzamide
CID 54905013
N-(2-aminocyclohexyl)-6-oxo-1H-pyridine-2-carboxamide
CID 114040267
phenyl N-(2-aminocycloheptyl)carbamate
CID 63259010
N-(2-aminocycloheptyl)-3,4,5-trifluorobenzamide
CID 63258010
N-(2-aminocycloheptyl)-2-pyridin-3-ylacetamide
CID 55169173

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocycloheptyl)thiadiazole-4-carboxamide?
The IUPAC name of N-(2-aminocycloheptyl)thiadiazole-4-carboxamide (CID 65216552) is N-(2-aminocycloheptyl)thiadiazole-4-carboxamide.
What is the SMILES notation for N-(2-aminocycloheptyl)thiadiazole-4-carboxamide?
The canonical SMILES for N-(2-aminocycloheptyl)thiadiazole-4-carboxamide is NC1CCCCCC1NC(=O)c1csnn1.
What is the InChIKey of N-(2-aminocycloheptyl)thiadiazole-4-carboxamide?
The InChIKey is KQCNBRKMAYSJDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4OS/c11-7-4-2-1-3-5-8(7)12-10(15)9-6-16-14-13-9/h6-8H,1-5,11H2,(H,12,15).
What are the key properties of N-(2-aminocycloheptyl)thiadiazole-4-carboxamide?
N-(2-aminocycloheptyl)thiadiazole-4-carboxamide has a molecular weight of 240.33 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocycloheptyl)thiadiazole-4-carboxamide is sourced from PubChem (CID 65216552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).