N-(2-phenoxyethoxy)furan-2-carboxamide

C13H13NO4 — CID 110294654

IUPACN-(2-phenoxyethoxy)furan-2-carboxamide
SMILESO=C(NOCCOc1ccccc1)c1ccco1
InChIInChI=1S/C13H13NO4/c15-13(12-7-4-8-17-12)14-18-10-9-16-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,14,15)
InChIKeyRYXCQEIDZBVVIT-UHFFFAOYSA-N
MW247.25 g/mol
LogP2.02
Rot. Bonds6

About N-(2-phenoxyethoxy)furan-2-carboxamide

N-(2-phenoxyethoxy)furan-2-carboxamide (PubChem CID 110294654) has the molecular formula C13H13NO4 and a molecular weight of 247.25 g/mol. Its IUPAC name is N-(2-phenoxyethoxy)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-phenoxyethoxy)furan-2-carboxamide
PubChem CID110294654
Molecular FormulaC13H13NO4
Molecular Weight247.25 g/mol
Exact Mass247.08
IUPAC NameN-(2-phenoxyethoxy)furan-2-carboxamide
SMILESO=C(NOCCOc1ccccc1)c1ccco1
InChIInChI=1S/C13H13NO4/c15-13(12-7-4-8-17-12)14-18-10-9-16-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,14,15)
InChIKeyRYXCQEIDZBVVIT-UHFFFAOYSA-N
XLogP2.02
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-phenoxyethoxy)-2-phenylacetamide
CID 110294668
4-methoxy-N-(2-phenoxyethoxy)benzamide
CID 110294662
N-[4-(4-phenoxybutanoylamino)phenyl]furan-2-carboxamide
CID 30907632
1-benzyl-3-(2-phenoxyethoxy)urea
CID 110354986
2-(2-phenoxyethoxyamino)prop-2-enoic acid
CID 56625837
2-(4-methylphenoxy)ethyl (2S)-2-(furan-2-carbonylamino)-3-phenylpropanoate
CID 8578888
N-[3-[[2-oxo-2-[3-(2-phenoxyethoxy)anilino]ethyl]amino]phenyl]furan-2-carboxamide
CID 54843570
N-[(1S)-1-[1-(3-phenoxypropyl)benzimidazol-2-yl]ethyl]furan-2-carboxamide
CID 42100825
N-[(1R)-1-[1-(3-phenoxypropyl)benzimidazol-2-yl]ethyl]furan-2-carboxamide
CID 42100824
2-(3-ethylphenoxy)ethyl 2-(furan-2-carbonylamino)-3-phenylpropanoate
CID 55316536
N-(2-phenoxyethoxy)cyclopropanecarboxamide
CID 110294647
2-(4-chlorophenoxy)ethyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]acetate
CID 8875533

Frequently Asked Questions

What is the IUPAC name of N-(2-phenoxyethoxy)furan-2-carboxamide?
The IUPAC name of N-(2-phenoxyethoxy)furan-2-carboxamide (CID 110294654) is N-(2-phenoxyethoxy)furan-2-carboxamide.
What is the SMILES notation for N-(2-phenoxyethoxy)furan-2-carboxamide?
The canonical SMILES for N-(2-phenoxyethoxy)furan-2-carboxamide is O=C(NOCCOc1ccccc1)c1ccco1.
What is the InChIKey of N-(2-phenoxyethoxy)furan-2-carboxamide?
The InChIKey is RYXCQEIDZBVVIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO4/c15-13(12-7-4-8-17-12)14-18-10-9-16-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,14,15).
What are the key properties of N-(2-phenoxyethoxy)furan-2-carboxamide?
N-(2-phenoxyethoxy)furan-2-carboxamide has a molecular weight of 247.25 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenoxyethoxy)furan-2-carboxamide is sourced from PubChem (CID 110294654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).