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

C14H15NO2 — CID 844275

IUPACN-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(C)c(C)c2)o1
InChIInChI=1S/C14H15NO2/c1-9-4-6-12(8-10(9)2)15-14(16)13-7-5-11(3)17-13/h4-8H,1-3H3,(H,15,16)
InChIKeyCSQFCMFIKCILBU-UHFFFAOYSA-N
MW229.28 g/mol
LogP3.46
Rot. Bonds2

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

N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide (PubChem CID 844275) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide
PubChem CID844275
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC NameN-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccc(C)c(C)c2)o1
InChIInChI=1S/C14H15NO2/c1-9-4-6-12(8-10(9)2)15-14(16)13-7-5-11(3)17-13/h4-8H,1-3H3,(H,15,16)
InChIKeyCSQFCMFIKCILBU-UHFFFAOYSA-N
XLogP3.46
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-(3,4-dimethylphenyl)furan-2-carboxamide
CID 730613
N-(3,4-dimethylphenyl)-4,5-dimethylfuran-2-carboxamide
CID 2988789
5-methyl-N-pyridin-4-ylfuran-2-carboxamide
CID 897103
N-(3-amino-4-methoxyphenyl)-5-methylfuran-2-carboxamide
CID 43599890
N-(3-chloro-4-fluorophenyl)-5-methylfuran-2-carboxamide
CID 844340
2-fluoro-4-[(5-methylfuran-2-carbonyl)amino]benzoic acid
CID 103791548
5-methyl-N-[4-(methylcarbamoylamino)phenyl]furan-2-carboxamide
CID 52555638
N-(3,4-dimethylphenyl)-5-[(4-methylphenoxy)methyl]furan-2-carboxamide
CID 18830628
N-(3,4-dimethylphenyl)furan-2-carboxamide
CID 689600
3-(3,4-dimethylanilino)-1-(5-methylfuran-2-yl)propan-1-one
CID 877362
N-(3,4-dimethylphenyl)-5-(2-fluorophenyl)furan-2-carboxamide
CID 3872686
N-(4-ethoxy-3-methoxyphenyl)-5-methylfuran-2-carboxamide
CID 17439560

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide?
The IUPAC name of N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide (CID 844275) is N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide is Cc1ccc(C(=O)Nc2ccc(C)c(C)c2)o1.
What is the InChIKey of N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide?
The InChIKey is CSQFCMFIKCILBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-9-4-6-12(8-10(9)2)15-14(16)13-7-5-11(3)17-13/h4-8H,1-3H3,(H,15,16).
What are the key properties of N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide?
N-(3,4-dimethylphenyl)-5-methylfuran-2-carboxamide has a molecular weight of 229.28 g/mol, XLogP of 3.46, 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)-5-methylfuran-2-carboxamide is sourced from PubChem (CID 844275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).