N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide

C10H12N2OS — CID 43594331

IUPACN-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide
SMILESO=C(NC1C2CNCC21)c1ccsc1
InChIInChI=1S/C10H12N2OS/c13-10(6-1-2-14-5-6)12-9-7-3-11-4-8(7)9/h1-2,5,7-9,11H,3-4H2,(H,12,13)
InChIKeySUJVLKUNTWNQIX-UHFFFAOYSA-N
MW208.29 g/mol
LogP0.70
Rot. Bonds2

About N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide

N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide (PubChem CID 43594331) has the molecular formula C10H12N2OS and a molecular weight of 208.29 g/mol. Its IUPAC name is N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide
PubChem CID43594331
Molecular FormulaC10H12N2OS
Molecular Weight208.29 g/mol
Exact Mass208.07
IUPAC NameN-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide
SMILESO=C(NC1C2CNCC21)c1ccsc1
InChIInChI=1S/C10H12N2OS/c13-10(6-1-2-14-5-6)12-9-7-3-11-4-8(7)9/h1-2,5,7-9,11H,3-4H2,(H,12,13)
InChIKeySUJVLKUNTWNQIX-UHFFFAOYSA-N
XLogP0.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 66187231
N-(2-adamantyl)thiophene-3-carboxamide
CID 24555583
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CID 71645364
N-[(3R)-5-oxopyrrolidin-3-yl]thiophene-3-carboxamide
CID 95985002
N-[(3S,4R)-4-(thiophene-3-carbonylamino)oxolan-3-yl]thiophene-3-carboxamide
CID 138021648
N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)thiophene-3-carboxamide
CID 66196694
N-(3-aminocyclobutyl)thiophene-3-carboxamide
CID 43594920
N-[(3S,3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-furo[3,4-b]pyrrol-3-yl]thiophene-3-carboxamide;hydrochloride
CID 155839888
N-[2-(thiophene-3-carbonylamino)ethyl]thiophene-3-carboxamide
CID 101004058
2-(azetidin-3-yl)-1-thiophen-3-ylethanone
CID 116582227
N-[3-(hydroxymethyl)cyclobutyl]thiophene-3-carboxamide
CID 164653916
N-(3-azabicyclo[3.1.0]hexan-6-yl)-3-bromo-4-fluorobenzamide
CID 107956016

Frequently Asked Questions

What is the IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide?
The IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide (CID 43594331) is N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide.
What is the SMILES notation for N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide?
The canonical SMILES for N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide is O=C(NC1C2CNCC21)c1ccsc1.
What is the InChIKey of N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide?
The InChIKey is SUJVLKUNTWNQIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2OS/c13-10(6-1-2-14-5-6)12-9-7-3-11-4-8(7)9/h1-2,5,7-9,11H,3-4H2,(H,12,13).
What are the key properties of N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide?
N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide has a molecular weight of 208.29 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide is sourced from PubChem (CID 43594331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).