N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide

C16H19NO2 — CID 60528113

IUPACN-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide
SMILESCCCC(=O)N(Cc1ccco1)c1ccc(C)cc1
InChIInChI=1S/C16H19NO2/c1-3-5-16(18)17(12-15-6-4-11-19-15)14-9-7-13(2)8-10-14/h4,6-11H,3,5,12H2,1-2H3
InChIKeyWJOXKKDRFDSOQI-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.92
Rot. Bonds5

About N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide

N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide (PubChem CID 60528113) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide
PubChem CID60528113
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide
SMILESCCCC(=O)N(Cc1ccco1)c1ccc(C)cc1
InChIInChI=1S/C16H19NO2/c1-3-5-16(18)17(12-15-6-4-11-19-15)14-9-7-13(2)8-10-14/h4,6-11H,3,5,12H2,1-2H3
InChIKeyWJOXKKDRFDSOQI-UHFFFAOYSA-N
XLogP3.92
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(furan-2-ylmethyl)-2-(1-methyl-5-oxo-4H-pyrazol-3-yl)-N-(4-methylphenyl)acetamide
CID 75396623
3-acetamido-N-(furan-2-ylmethyl)-N,3-bis(4-methylphenyl)propanamide
CID 43040064
2,4-difluoro-N-[3-[N-(furan-2-ylmethyl)-4-methylanilino]-3-oxopropyl]benzamide
CID 30670484
3,5-difluoro-N-(furan-2-ylmethyl)-N-(4-methylphenyl)benzamide
CID 18226162
N-(furan-2-ylmethyl)-2-(2-methoxy-4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 31964022
2-(benzotriazol-1-yl)-N-(furan-2-ylmethyl)-N-(4-methylphenyl)acetamide
CID 51189023
N-(furan-2-ylmethyl)-N-(4-methylphenyl)-2-(2-oxoazocan-1-yl)acetamide
CID 55756275
2-[(4-chlorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-(4-methylphenyl)acetamide
CID 1167420
N-(furan-2-ylmethyl)-2-[methyl-(4-methylphenyl)sulfonylamino]-N-phenylacetamide
CID 18100578
N-(furan-2-ylmethyl)-N-(4-methylphenyl)-4-oxo-3-propylphthalazine-1-carboxamide
CID 31963957
N-(furan-2-ylmethyl)-N-(4-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 134011749
N-(furan-2-ylmethyl)-N-(4-methylphenyl)pyrazine-2-carboxamide
CID 18192896

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide (CID 60528113) is N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide is CCCC(=O)N(Cc1ccco1)c1ccc(C)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide?
The InChIKey is WJOXKKDRFDSOQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-3-5-16(18)17(12-15-6-4-11-19-15)14-9-7-13(2)8-10-14/h4,6-11H,3,5,12H2,1-2H3.
What are the key properties of N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide?
N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide has a molecular weight of 257.33 g/mol, XLogP of 3.92, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-(4-methylphenyl)butanamide is sourced from PubChem (CID 60528113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).