N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide

C18H21N3O4 — CID 9225396

IUPACN-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide
SMILESCCCc1ccc(NC(=O)CNC(=O)CNC(=O)c2ccco2)cc1
InChIInChI=1S/C18H21N3O4/c1-2-4-13-6-8-14(9-7-13)21-17(23)12-19-16(22)11-20-18(24)15-5-3-10-25-15/h3,5-10H,2,4,11-12H2,1H3,(H,19,22)(H,20,24)(H,21,23)
InChIKeyUHZNFLDQAXVXKP-UHFFFAOYSA-N
MW343.38 g/mol
LogP1.72
Rot. Bonds8

About N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide

N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide (PubChem CID 9225396) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide
PubChem CID9225396
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC NameN-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide
SMILESCCCc1ccc(NC(=O)CNC(=O)CNC(=O)c2ccco2)cc1
InChIInChI=1S/C18H21N3O4/c1-2-4-13-6-8-14(9-7-13)21-17(23)12-19-16(22)11-20-18(24)15-5-3-10-25-15/h3,5-10H,2,4,11-12H2,1H3,(H,19,22)(H,20,24)(H,21,23)
InChIKeyUHZNFLDQAXVXKP-UHFFFAOYSA-N
XLogP1.72
TPSA100.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-[2-oxo-2-(4-propylanilino)ethyl]furan-2-carboxamide
CID 9294205
N-[2-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 7535615
N-[2-[[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 9269646
N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide
CID 9141000
N-[2-oxo-2-(3-phenylpropylamino)ethyl]furan-2-carboxamide
CID 2524355
N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]furan-2-carboxamide
CID 6461351
N-[2-[[2-[(3-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 43035097
N-[2-(3-methylsulfanylanilino)-2-oxoethyl]furan-2-carboxamide
CID 9402829
N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 24598074
N-[4-[[2-(2,6-dimethylanilino)-2-oxoethyl]carbamoyl]phenyl]furan-2-carboxamide
CID 27760510
2-phenyl-N-(4-propylphenyl)acetamide
CID 126501660
N-phenyl-2-(4-propylanilino)acetamide
CID 43215416

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide (CID 9225396) is N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide is CCCc1ccc(NC(=O)CNC(=O)CNC(=O)c2ccco2)cc1.
What is the InChIKey of N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide?
The InChIKey is UHZNFLDQAXVXKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-2-4-13-6-8-14(9-7-13)21-17(23)12-19-16(22)11-20-18(24)15-5-3-10-25-15/h3,5-10H,2,4,11-12H2,1H3,(H,19,22)(H,20,24)(H,21,23).
What are the key properties of N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide?
N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide has a molecular weight of 343.38 g/mol, XLogP of 1.72, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide is sourced from PubChem (CID 9225396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).