N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide

C15H17NO2 — CID 2988789

IUPACN-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc(C)c(C)o2)cc1C
InChIInChI=1S/C15H17NO2/c1-9-5-6-13(7-10(9)2)16-15(17)14-8-11(3)12(4)18-14/h5-8H,1-4H3,(H,16,17)
InChIKeyPCHLPWDHGUEDSM-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.77
Rot. Bonds2

About N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide

N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide (PubChem CID 2988789) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide
PubChem CID2988789
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC NameN-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc(C)c(C)o2)cc1C
InChIInChI=1S/C15H17NO2/c1-9-5-6-13(7-10(9)2)16-15(17)14-8-11(3)12(4)18-14/h5-8H,1-4H3,(H,16,17)
InChIKeyPCHLPWDHGUEDSM-UHFFFAOYSA-N
XLogP3.77
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide
CID 844275
5-bromo-N-(3,4-dimethylphenyl)furan-2-carboxamide
CID 730613
(E)-3-[4-[(4,5-dimethylfuran-2-carbonyl)amino]phenyl]prop-2-enoic acid
CID 86782516
N-(3,4-dimethylphenyl)furan-2-carboxamide
CID 689600
5-[(3,4-dimethylphenyl)carbamoyl]furan-3-carboxylic acid
CID 104607082
N,N'-bis(3,4-dimethylphenyl)oxamide
CID 3278038
N-(3,4-dimethylphenyl)-2,4,5-trimethylbenzamide
CID 100707473
N-(3,4-dimethylphenyl)-4,5-dimethyl-1,2-oxazole-3-carboxamide
CID 19589954
N-(3,4-dimethylphenyl)-5-(2-fluorophenyl)furan-2-carboxamide
CID 3872686
N-(3,4-dimethylphenyl)-2,3,4-trimethylbenzamide
CID 163590509
1-N-(4-acetylphenyl)-4-N-(3,4-dimethylphenyl)benzene-1,4-dicarboxamide
CID 109049646
N-(3,4-dimethylphenyl)-4-methylpyridine-2-carboxamide
CID 110857354

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide?
The IUPAC name of N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide (CID 2988789) is N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide is Cc1ccc(NC(=O)c2cc(C)c(C)o2)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide?
The InChIKey is PCHLPWDHGUEDSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-9-5-6-13(7-10(9)2)16-15(17)14-8-11(3)12(4)18-14/h5-8H,1-4H3,(H,16,17).
What are the key properties of N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide?
N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide is sourced from PubChem (CID 2988789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).