N-(3-aminocyclobutyl)furan-2-carboxamide

C9H12N2O2 — CID 43594882

IUPACN-(3-aminocyclobutyl)furan-2-carboxamide
SMILESNC1CC(NC(=O)c2ccco2)C1
InChIInChI=1S/C9H12N2O2/c10-6-4-7(5-6)11-9(12)8-2-1-3-13-8/h1-3,6-7H,4-5,10H2,(H,11,12)
InChIKeyRYYLARWATWIRLF-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.50
Rot. Bonds2

About N-(3-aminocyclobutyl)furan-2-carboxamide

N-(3-aminocyclobutyl)furan-2-carboxamide (PubChem CID 43594882) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is N-(3-aminocyclobutyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(3-aminocyclobutyl)furan-2-carboxamide
PubChem CID43594882
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC NameN-(3-aminocyclobutyl)furan-2-carboxamide
SMILESNC1CC(NC(=O)c2ccco2)C1
InChIInChI=1S/C9H12N2O2/c10-6-4-7(5-6)11-9(12)8-2-1-3-13-8/h1-3,6-7H,4-5,10H2,(H,11,12)
InChIKeyRYYLARWATWIRLF-UHFFFAOYSA-N
XLogP0.50
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl)furan-2-carboxamide
CID 115267746
N-(3,5-dimethylcyclohexyl)furan-2-carboxamide
CID 64722741
N-cyclooctylfuran-2-carboxamide
CID 790432
N-(1,1-dioxothietan-3-yl)furan-2-carboxamide
CID 130935311
N-(4-bromocyclohexyl)furan-2-carboxamide
CID 114309141
N-[4-(2-hydroxyethyl)cyclohexyl]furan-2-carboxamide
CID 115270358
N-(thiolan-3-yl)furan-2-carboxamide
CID 103708637
N-(1-ethylazetidin-3-yl)furan-2-carboxamide
CID 130639837
N-(2,2-dimethyloxan-4-yl)furan-2-carboxamide
CID 115563926
ethyl N-[4-(furan-2-carbonylamino)cyclohexyl]carbamate
CID 100613530
N-(3-aminocyclobutyl)benzamide
CID 43594893
methyl 2-[4-(furan-2-carbonylamino)cyclohexyl]acetate
CID 115270327

Frequently Asked Questions

What is the IUPAC name of N-(3-aminocyclobutyl)furan-2-carboxamide?
The IUPAC name of N-(3-aminocyclobutyl)furan-2-carboxamide (CID 43594882) is N-(3-aminocyclobutyl)furan-2-carboxamide.
What is the SMILES notation for N-(3-aminocyclobutyl)furan-2-carboxamide?
The canonical SMILES for N-(3-aminocyclobutyl)furan-2-carboxamide is NC1CC(NC(=O)c2ccco2)C1.
What is the InChIKey of N-(3-aminocyclobutyl)furan-2-carboxamide?
The InChIKey is RYYLARWATWIRLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c10-6-4-7(5-6)11-9(12)8-2-1-3-13-8/h1-3,6-7H,4-5,10H2,(H,11,12).
What are the key properties of N-(3-aminocyclobutyl)furan-2-carboxamide?
N-(3-aminocyclobutyl)furan-2-carboxamide has a molecular weight of 180.21 g/mol, XLogP of 0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminocyclobutyl)furan-2-carboxamide is sourced from PubChem (CID 43594882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).