N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide

C18H23N3O3 — CID 17229741

IUPACN-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C18H23N3O3/c1-3-21(4-2)12-11-19-17(22)14-7-9-15(10-8-14)20-18(23)16-6-5-13-24-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyKLMZLHIFCHNQIR-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.60
Rot. Bonds8

About N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide

N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide (PubChem CID 17229741) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide
PubChem CID17229741
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC NameN-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C18H23N3O3/c1-3-21(4-2)12-11-19-17(22)14-7-9-15(10-8-14)20-18(23)16-6-5-13-24-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyKLMZLHIFCHNQIR-UHFFFAOYSA-N
XLogP2.60
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[3-(diethylamino)propylcarbamoyl]phenyl]furan-2-carboxamide
CID 17407524
N-[4-[2-(N-ethyl-2-methylanilino)ethylcarbamoyl]phenyl]furan-2-carboxamide
CID 46478628
N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 4782277
N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-4-phenylbenzamide
CID 17229715
4-acetamido-N-[2-(diethylamino)ethyl]benzamide;hydron;chloride
CID 67108272
N-[4-[benzyl(ethyl)carbamoyl]phenyl]furan-2-carboxamide
CID 17399777
2-chloro-N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]benzamide
CID 12500967
N-[4-[(4-acetamidophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 24628897
N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 2979994
N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-2-iodobenzamide
CID 17229734
N-[4-(furan-2-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 976453
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide (CID 17229741) is N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide is CCN(CC)CCNC(=O)c1ccc(NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is KLMZLHIFCHNQIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-3-21(4-2)12-11-19-17(22)14-7-9-15(10-8-14)20-18(23)16-6-5-13-24-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,22)(H,20,23).
What are the key properties of N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide?
N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 2.60, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 17229741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).