N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide

C11H14N2O2 — CID 155850992

IUPACN-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide
SMILESO=C(NC1CC2CCC1N2)c1ccco1
InChIInChI=1S/C11H14N2O2/c14-11(10-2-1-5-15-10)13-9-6-7-3-4-8(9)12-7/h1-2,5,7-9,12H,3-4,6H2,(H,13,14)
InChIKeyKTHKQBSSCBUBGV-UHFFFAOYSA-N
MW206.24 g/mol
LogP0.90
Rot. Bonds2

About N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide

N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide (PubChem CID 155850992) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide
PubChem CID155850992
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC NameN-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide
SMILESO=C(NC1CC2CCC1N2)c1ccco1
InChIInChI=1S/C11H14N2O2/c14-11(10-2-1-5-15-10)13-9-6-7-3-4-8(9)12-7/h1-2,5,7-9,12H,3-4,6H2,(H,13,14)
InChIKeyKTHKQBSSCBUBGV-UHFFFAOYSA-N
XLogP0.90
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-5-[3-(furan-2-yl)phenyl]furan-2-carboxamide
CID 70025706
N-[(1S,2R,4S)-7-azabicyclo[2.2.1]heptan-2-yl]-5-(4-methylphenyl)furan-2-carboxamide
CID 15978646
N-[(1R,2R)-2-hydroxycyclohexyl]furan-2-carboxamide
CID 27126578
N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-5-[2-(5-methylfuran-2-yl)phenyl]furan-2-carboxamide
CID 70026440
N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-5-pyridin-3-ylfuran-2-carboxamide
CID 70027681
N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-5-(3-chlorophenyl)furan-2-carboxamide
CID 70026122
N-(7-azabicyclo[2.2.1]heptan-2-yl)-5-(2-methoxyphenyl)furan-2-carboxamide
CID 18535430
N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-5-(4-ethylphenyl)furan-2-carboxamide
CID 70028089
N-(7-azabicyclo[2.2.1]heptan-2-yl)-5-[3-(1,3-oxazol-2-yl)phenyl]furan-2-carboxamide
CID 18535376
N-(7-azabicyclo[2.2.1]heptan-2-yl)-5-[3-(5-methylfuran-2-yl)phenyl]furan-2-carboxamide
CID 18535759
N-[(2R)-7-azabicyclo[2.2.1]heptan-2-yl]-5-(4-fluorophenyl)furan-2-carboxamide;iodomethane
CID 161354262
N-(7-azabicyclo[2.2.1]heptan-2-yl)-5-(2-fluoro-3-pyridinyl)furan-2-carboxamide
CID 18534899

Frequently Asked Questions

What is the IUPAC name of N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide?
The IUPAC name of N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide (CID 155850992) is N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide.
What is the SMILES notation for N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide?
The canonical SMILES for N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide is O=C(NC1CC2CCC1N2)c1ccco1.
What is the InChIKey of N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide?
The InChIKey is KTHKQBSSCBUBGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c14-11(10-2-1-5-15-10)13-9-6-7-3-4-8(9)12-7/h1-2,5,7-9,12H,3-4,6H2,(H,13,14).
What are the key properties of N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide?
N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide has a molecular weight of 206.24 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-azabicyclo[2.2.1]heptan-2-yl)furan-2-carboxamide is sourced from PubChem (CID 155850992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).