N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide

C8H10N4OS — CID 130748133

IUPACN-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide
SMILESO=C(NC1[C@H]2CNC[C@@H]12)c1cnns1
InChIInChI=1S/C8H10N4OS/c13-8(6-3-10-12-14-6)11-7-4-1-9-2-5(4)7/h3-5,7,9H,1-2H2,(H,11,13)/t4-,5+,7?
InChIKeyYOMZPTFBQXBZCY-VAPWPJCZSA-N
MW210.26 g/mol
LogP-0.51
Rot. Bonds2

About N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide

N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide (PubChem CID 130748133) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide
PubChem CID130748133
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC NameN-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide
SMILESO=C(NC1[C@H]2CNC[C@@H]12)c1cnns1
InChIInChI=1S/C8H10N4OS/c13-8(6-3-10-12-14-6)11-7-4-1-9-2-5(4)7/h3-5,7,9H,1-2H2,(H,11,13)/t4-,5+,7?
InChIKeyYOMZPTFBQXBZCY-VAPWPJCZSA-N
XLogP-0.51
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide?
The IUPAC name of N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide (CID 130748133) is N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide.
What is the SMILES notation for N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide?
The canonical SMILES for N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide is O=C(NC1[C@H]2CNC[C@@H]12)c1cnns1.
What is the InChIKey of N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide?
The InChIKey is YOMZPTFBQXBZCY-VAPWPJCZSA-N. The full InChI is InChI=1S/C8H10N4OS/c13-8(6-3-10-12-14-6)11-7-4-1-9-2-5(4)7/h3-5,7,9H,1-2H2,(H,11,13)/t4-,5+,7?.
What are the key properties of N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide?
N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide has a molecular weight of 210.26 g/mol, XLogP of -0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]thiadiazole-5-carboxamide is sourced from PubChem (CID 130748133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).