N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide

C21H20N2O5 — CID 51327622

IUPACN-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide
SMILESCOc1ccc(OC(C)C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)cc1
InChIInChI=1S/C21H20N2O5/c1-14(28-18-11-9-17(26-2)10-12-18)20(24)22-15-5-7-16(8-6-15)23-21(25)19-4-3-13-27-19/h3-14H,1-2H3,(H,22,24)(H,23,25)
InChIKeyOIADFCSTMNOVRP-UHFFFAOYSA-N
MW380.40 g/mol
LogP3.95
Rot. Bonds7

About N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide

N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide (PubChem CID 51327622) has the molecular formula C21H20N2O5 and a molecular weight of 380.40 g/mol. Its IUPAC name is N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide
PubChem CID51327622
Molecular FormulaC21H20N2O5
Molecular Weight380.40 g/mol
Exact Mass380.14
IUPAC NameN-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide
SMILESCOc1ccc(OC(C)C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)cc1
InChIInChI=1S/C21H20N2O5/c1-14(28-18-11-9-17(26-2)10-12-18)20(24)22-15-5-7-16(8-6-15)23-21(25)19-4-3-13-27-19/h3-14H,1-2H3,(H,22,24)(H,23,25)
InChIKeyOIADFCSTMNOVRP-UHFFFAOYSA-N
XLogP3.95
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.40
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[2-(4-phenylphenoxy)propanoylamino]phenyl]furan-2-carboxamide
CID 46686822
N-[2-[[4-[2-(4-methoxyphenoxy)propanoylamino]benzoyl]amino]ethyl]furan-2-carboxamide
CID 121062881
N-[4-[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl]oxyphenyl]furan-2-carboxamide
CID 41324439
4-[2-(4-methoxyphenoxy)propanoylamino]-N-(4-methoxyphenyl)benzamide
CID 55504736
N-[2-(2-phenoxypropanoylamino)phenyl]furan-2-carboxamide
CID 2993584
N-[2-[[4-(2-phenoxypropanoylamino)benzoyl]amino]ethyl]furan-2-carboxamide
CID 121062862
N-[(4-propan-2-yloxyphenyl)carbamoyl]furan-2-carboxamide
CID 110866473
(2R)-N-(4-anilinophenyl)-2-(4-methoxyphenoxy)propanamide
CID 2203307
2-(4-methoxyphenoxy)-N-(4-phenoxyphenyl)propanamide
CID 2952537
N-(4-methoxyphenyl)-2-(4-phenylphenoxy)propanamide
CID 4951720
N-[2-[(4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 722971
N-(4-iodophenyl)-2-(4-methoxyphenoxy)propanamide
CID 2952531

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide (CID 51327622) is N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide is COc1ccc(OC(C)C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)cc1.
What is the InChIKey of N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide?
The InChIKey is OIADFCSTMNOVRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O5/c1-14(28-18-11-9-17(26-2)10-12-18)20(24)22-15-5-7-16(8-6-15)23-21(25)19-4-3-13-27-19/h3-14H,1-2H3,(H,22,24)(H,23,25).
What are the key properties of N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide?
N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide has a molecular weight of 380.40 g/mol, XLogP of 3.95, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-methoxyphenoxy)propanoylamino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 51327622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).