N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide

C20H23N3O3 — CID 155524035

IUPACN-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2cc(C)oc2-c2cc(C)on2)cc1
InChIInChI=1S/C20H23N3O3/c1-5-23(6-2)16-9-7-15(8-10-16)21-20(24)17-11-13(3)25-19(17)18-12-14(4)26-22-18/h7-12H,5-6H2,1-4H3,(H,21,24)
InChIKeyODEKNMDFMSYWJO-UHFFFAOYSA-N
MW353.42 g/mol
LogP4.65
Rot. Bonds6

About N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide

N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide (PubChem CID 155524035) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide.

Molecular Properties

Compound NameN-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide
PubChem CID155524035
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC NameN-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2cc(C)oc2-c2cc(C)on2)cc1
InChIInChI=1S/C20H23N3O3/c1-5-23(6-2)16-9-7-15(8-10-16)21-20(24)17-11-13(3)25-19(17)18-12-14(4)26-22-18/h7-12H,5-6H2,1-4H3,(H,21,24)
InChIKeyODEKNMDFMSYWJO-UHFFFAOYSA-N
XLogP4.65
TPSA71.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-[4-(diethylamino)anilino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 109010414
N-[4-(diethylamino)phenyl]-2-(5-methylfuran-2-yl)quinoline-4-carboxamide
CID 3408470
N-[4-(1-benzofuran-3-carbonylamino)phenyl]-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide
CID 50995778
N-[4-(diethylamino)phenyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 43066871
N-[4-(diethylamino)phenyl]-2-hydroxy-5-methylbenzamide
CID 39122388
N-[4-(diethylamino)phenyl]-2-oxochromene-3-carboxamide
CID 694759
2-N,6-N-bis[4-(diethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 1019302
3-tert-butyl-N-[4-(diethylamino)phenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 110424770
2-[[4-(diethylamino)phenyl]carbamoyl]benzoic acid
CID 730395
N-[4-(diethylamino)phenyl]-2,4,6-trimethylbenzamide
CID 19167686
N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-2,5-dimethylfuran-3-carboxamide
CID 5413783
N-[4-(diethylamino)phenyl]-2-fluorobenzamide
CID 842943

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide?
The IUPAC name of N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide (CID 155524035) is N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide.
What is the SMILES notation for N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide?
The canonical SMILES for N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide is CCN(CC)c1ccc(NC(=O)c2cc(C)oc2-c2cc(C)on2)cc1.
What is the InChIKey of N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide?
The InChIKey is ODEKNMDFMSYWJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-5-23(6-2)16-9-7-15(8-10-16)21-20(24)17-11-13(3)25-19(17)18-12-14(4)26-22-18/h7-12H,5-6H2,1-4H3,(H,21,24).
What are the key properties of N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide?
N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide has a molecular weight of 353.42 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylamino)phenyl]-5-methyl-2-(5-methyl-1,2-oxazol-3-yl)furan-3-carboxamide is sourced from PubChem (CID 155524035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).