2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide

C17H21NO2 — CID 18098041

IUPAC2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide
SMILESCCCc1ccc(NC(=O)c2c(C)oc(C)c2C)cc1
InChIInChI=1S/C17H21NO2/c1-5-6-14-7-9-15(10-8-14)18-17(19)16-11(2)12(3)20-13(16)4/h7-10H,5-6H2,1-4H3,(H,18,19)
InChIKeyCHFSTBWXGBDOGD-UHFFFAOYSA-N
MW271.36 g/mol
LogP4.41
Rot. Bonds4

About 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide

2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide (PubChem CID 18098041) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide.

Molecular Properties

Compound Name2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide
PubChem CID18098041
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide
SMILESCCCc1ccc(NC(=O)c2c(C)oc(C)c2C)cc1
InChIInChI=1S/C17H21NO2/c1-5-6-14-7-9-15(10-8-14)18-17(19)16-11(2)12(3)20-13(16)4/h7-10H,5-6H2,1-4H3,(H,18,19)
InChIKeyCHFSTBWXGBDOGD-UHFFFAOYSA-N
XLogP4.41
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4,5-trimethyl-N-(4-methylphenyl)furan-3-carboxamide
CID 26719687
N-(4-bromophenyl)-2,4,5-trimethylfuran-3-carboxamide
CID 26719141
methyl 4-[(2,4,5-trimethylfuran-3-carbonyl)amino]benzoate
CID 26720131
N-(3-amino-4-ethylphenyl)-2,4,5-trimethylfuran-3-carboxamide
CID 62058076
N-(4-carbamothioylphenyl)-2,4,5-trimethylfuran-3-carboxamide
CID 65152789
N-(3,4-dichlorophenyl)-2,4,5-trimethylfuran-3-carboxamide
CID 26719667
2,4-dimethyl-N-(4-propylphenyl)benzamide
CID 42237293
5-bromo-N-[2-oxo-2-(4-propylanilino)ethyl]furan-2-carboxamide
CID 9294205
N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide
CID 51246740
2,4,5-trimethyl-N-(3-pyrrol-1-ylphenyl)furan-3-carboxamide
CID 47093125
2-methyl-N-(4-propylphenyl)propanamide
CID 58658667
2-amino-N-(4-propylphenyl)acetamide
CID 43216495

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide?
The IUPAC name of 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide (CID 18098041) is 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide.
What is the SMILES notation for 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide?
The canonical SMILES for 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide is CCCc1ccc(NC(=O)c2c(C)oc(C)c2C)cc1.
What is the InChIKey of 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide?
The InChIKey is CHFSTBWXGBDOGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-5-6-14-7-9-15(10-8-14)18-17(19)16-11(2)12(3)20-13(16)4/h7-10H,5-6H2,1-4H3,(H,18,19).
What are the key properties of 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide?
2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide has a molecular weight of 271.36 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-N-(4-propylphenyl)furan-3-carboxamide is sourced from PubChem (CID 18098041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).