N-(3-aminocyclobutyl)thiophene-3-carboxamide

C9H12N2OS — CID 43594920

IUPACN-(3-aminocyclobutyl)thiophene-3-carboxamide
SMILESNC1CC(NC(=O)c2ccsc2)C1
InChIInChI=1S/C9H12N2OS/c10-7-3-8(4-7)11-9(12)6-1-2-13-5-6/h1-2,5,7-8H,3-4,10H2,(H,11,12)
InChIKeyUEEDZPYCXVSUCB-UHFFFAOYSA-N
MW196.28 g/mol
LogP0.97
Rot. Bonds2

About N-(3-aminocyclobutyl)thiophene-3-carboxamide

N-(3-aminocyclobutyl)thiophene-3-carboxamide (PubChem CID 43594920) has the molecular formula C9H12N2OS and a molecular weight of 196.28 g/mol. Its IUPAC name is N-(3-aminocyclobutyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(3-aminocyclobutyl)thiophene-3-carboxamide
PubChem CID43594920
Molecular FormulaC9H12N2OS
Molecular Weight196.28 g/mol
Exact Mass196.07
IUPAC NameN-(3-aminocyclobutyl)thiophene-3-carboxamide
SMILESNC1CC(NC(=O)c2ccsc2)C1
InChIInChI=1S/C9H12N2OS/c10-7-3-8(4-7)11-9(12)6-1-2-13-5-6/h1-2,5,7-8H,3-4,10H2,(H,11,12)
InChIKeyUEEDZPYCXVSUCB-UHFFFAOYSA-N
XLogP0.97
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.28
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(hydroxymethyl)cyclobutyl]thiophene-3-carboxamide
CID 164653916
N-(azetidin-3-yl)thiophene-3-carboxamide
CID 66187231
N-(3-aminocyclobutyl)benzamide
CID 43594893
N-[1-(3-aminobicyclo[2.2.1]heptane-2-carbonyl)piperidin-4-yl]thiophene-3-carboxamide
CID 119752043
N-(2-adamantyl)thiophene-3-carboxamide
CID 24555583
N-[(3R)-5-oxopyrrolidin-3-yl]thiophene-3-carboxamide
CID 95985002
N-[(4aS,6R,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]dioxin-6-yl]thiophene-3-carboxamide
CID 124843923
N-[(3S,4R)-4-(thiophene-3-carbonylamino)oxolan-3-yl]thiophene-3-carboxamide
CID 138021648
N-(3-aminocyclobutyl)-5-iodothiophene-3-carboxamide
CID 79693813
N-[(3S)-piperidin-3-yl]thiophene-3-carboxamide
CID 71645364
N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide
CID 43594331
N-[1-(9-aminobicyclo[3.3.1]nonane-3-carbonyl)piperidin-4-yl]thiophene-3-carboxamide;hydrochloride
CID 120987409

Frequently Asked Questions

What is the IUPAC name of N-(3-aminocyclobutyl)thiophene-3-carboxamide?
The IUPAC name of N-(3-aminocyclobutyl)thiophene-3-carboxamide (CID 43594920) is N-(3-aminocyclobutyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(3-aminocyclobutyl)thiophene-3-carboxamide?
The canonical SMILES for N-(3-aminocyclobutyl)thiophene-3-carboxamide is NC1CC(NC(=O)c2ccsc2)C1.
What is the InChIKey of N-(3-aminocyclobutyl)thiophene-3-carboxamide?
The InChIKey is UEEDZPYCXVSUCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2OS/c10-7-3-8(4-7)11-9(12)6-1-2-13-5-6/h1-2,5,7-8H,3-4,10H2,(H,11,12).
What are the key properties of N-(3-aminocyclobutyl)thiophene-3-carboxamide?
N-(3-aminocyclobutyl)thiophene-3-carboxamide has a molecular weight of 196.28 g/mol, XLogP of 0.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminocyclobutyl)thiophene-3-carboxamide is sourced from PubChem (CID 43594920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).