N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide

C18H16N2O3 — CID 75457531

IUPACN-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(OCCc2cccnc2)c1)c1ccco1
InChIInChI=1S/C18H16N2O3/c21-18(17-7-3-10-23-17)20-15-5-1-6-16(12-15)22-11-8-14-4-2-9-19-13-14/h1-7,9-10,12-13H,8,11H2,(H,20,21)
InChIKeyUFXZKYYVILBPAZ-UHFFFAOYSA-N
MW308.34 g/mol
LogP3.55
Rot. Bonds6

About N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide

N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide (PubChem CID 75457531) has the molecular formula C18H16N2O3 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide
PubChem CID75457531
Molecular FormulaC18H16N2O3
Molecular Weight308.34 g/mol
Exact Mass308.12
IUPAC NameN-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(OCCc2cccnc2)c1)c1ccco1
InChIInChI=1S/C18H16N2O3/c21-18(17-7-3-10-23-17)20-15-5-1-6-16(12-15)22-11-8-14-4-2-9-19-13-14/h1-7,9-10,12-13H,8,11H2,(H,20,21)
InChIKeyUFXZKYYVILBPAZ-UHFFFAOYSA-N
XLogP3.55
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[[2-oxo-2-[3-(2-phenylethoxy)anilino]ethyl]amino]phenyl]furan-2-carboxamide
CID 54843325
N-[3-(3-methylbutoxy)phenyl]furan-2-carboxamide
CID 17097239
N-[3-[2-(2-methoxyethylamino)-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 46547454
N-[3-(2-aminoethoxy)phenyl]-3-pyridin-3-ylpropanamide
CID 81485538
N-[3-[[2-oxo-2-[3-(2-phenoxyethoxy)anilino]ethyl]amino]phenyl]furan-2-carboxamide
CID 54843570
N-[4-[(2-pyridin-3-ylacetyl)amino]phenyl]furan-2-carboxamide
CID 17297144
N-[3-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 46407349
N-[4-[[3-(pyridin-3-ylmethoxy)benzoyl]amino]-3-(trifluoromethyl)phenyl]furan-2-carboxamide
CID 112832589
N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide
CID 113027750
N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 56796448
N-[3-[[(3-pyridin-4-yloxyphenyl)carbamoylamino]methyl]phenyl]furan-2-carboxamide
CID 86940328
N-[3-[[2-(3-heptoxyanilino)-2-oxoethyl]amino]phenyl]furan-2-carboxamide
CID 54843293

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide (CID 75457531) is N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide is O=C(Nc1cccc(OCCc2cccnc2)c1)c1ccco1.
What is the InChIKey of N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide?
The InChIKey is UFXZKYYVILBPAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3/c21-18(17-7-3-10-23-17)20-15-5-1-6-16(12-15)22-11-8-14-4-2-9-19-13-14/h1-7,9-10,12-13H,8,11H2,(H,20,21).
What are the key properties of N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide?
N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide has a molecular weight of 308.34 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-pyridin-3-ylethoxy)phenyl]furan-2-carboxamide is sourced from PubChem (CID 75457531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).