N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide

C19H24N2O3 — CID 51246740

IUPACN-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide
SMILESCCN(CC)C(=O)c1cccc(NC(=O)c2c(C)oc(C)c2C)c1
InChIInChI=1S/C19H24N2O3/c1-6-21(7-2)19(23)15-9-8-10-16(11-15)20-18(22)17-12(3)13(4)24-14(17)5/h8-11H,6-7H2,1-5H3,(H,20,22)
InChIKeyRHUJUUDMHBHISG-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.94
Rot. Bonds5

About N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide

N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide (PubChem CID 51246740) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide
PubChem CID51246740
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC NameN-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide
SMILESCCN(CC)C(=O)c1cccc(NC(=O)c2c(C)oc(C)c2C)c1
InChIInChI=1S/C19H24N2O3/c1-6-21(7-2)19(23)15-9-8-10-16(11-15)20-18(22)17-12(3)13(4)24-14(17)5/h8-11H,6-7H2,1-5H3,(H,20,22)
InChIKeyRHUJUUDMHBHISG-UHFFFAOYSA-N
XLogP3.94
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(diethylcarbamoyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 26070791
N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide
CID 17194507
N-[3-(diethylcarbamoyl)phenyl]-3,5-dimethylbenzamide
CID 26712665
N-[3-(diethylcarbamoyl)phenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 51148639
N-[3-(diethylcarbamoyl)phenyl]-5-nitrofuran-2-carboxamide
CID 51148651
N-[3-(diethylcarbamoyl)phenyl]-3-(methylsulfonylmethyl)benzamide
CID 26313396
3-[[4-[(3-carboxyphenyl)carbamoyl]-2,5-dimethylfuran-3-carbonyl]amino]benzoic acid
CID 1267744
3-(2-chloro-6-fluorophenyl)-N-[3-(diethylcarbamoyl)phenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 31365657
3-[[4-(diethylaminomethyl)benzoyl]amino]-N,N-diethylbenzamide
CID 55645545
2-chloro-N-[3-(diethylcarbamoyl)phenyl]benzamide
CID 17194505
N,N-diethyl-3-(methylcarbamoylamino)benzamide
CID 47173763
N-[3-(diethylcarbamoyl)phenyl]-3-(prop-2-enoylamino)benzamide
CID 141125198

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide?
The IUPAC name of N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide (CID 51246740) is N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide.
What is the SMILES notation for N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide?
The canonical SMILES for N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide is CCN(CC)C(=O)c1cccc(NC(=O)c2c(C)oc(C)c2C)c1.
What is the InChIKey of N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide?
The InChIKey is RHUJUUDMHBHISG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-6-21(7-2)19(23)15-9-8-10-16(11-15)20-18(22)17-12(3)13(4)24-14(17)5/h8-11H,6-7H2,1-5H3,(H,20,22).
What are the key properties of N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide?
N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide has a molecular weight of 328.41 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide is sourced from PubChem (CID 51246740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).