N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide

C23H25NO2 — CID 4518197

IUPACN-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide
SMILESCC(C)(C)c1ccc(C(=O)N(Cc2ccccc2)Cc2ccco2)cc1
InChIInChI=1S/C23H25NO2/c1-23(2,3)20-13-11-19(12-14-20)22(25)24(17-21-10-7-15-26-21)16-18-8-5-4-6-9-18/h4-15H,16-17H2,1-3H3
InChIKeyGNDDFTISWPGQNM-UHFFFAOYSA-N
MW347.46 g/mol
LogP5.42
Rot. Bonds5

About N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide

N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide (PubChem CID 4518197) has the molecular formula C23H25NO2 and a molecular weight of 347.46 g/mol. Its IUPAC name is N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide
PubChem CID4518197
Molecular FormulaC23H25NO2
Molecular Weight347.46 g/mol
Exact Mass347.19
IUPAC NameN-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide
SMILESCC(C)(C)c1ccc(C(=O)N(Cc2ccccc2)Cc2ccco2)cc1
InChIInChI=1S/C23H25NO2/c1-23(2,3)20-13-11-19(12-14-20)22(25)24(17-21-10-7-15-26-21)16-18-8-5-4-6-9-18/h4-15H,16-17H2,1-3H3
InChIKeyGNDDFTISWPGQNM-UHFFFAOYSA-N
XLogP5.42
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.46
LogP ≤ 55.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-(furan-2-ylmethyl)-4-pentylbenzamide
CID 4518534
N-benzyl-2-(4-tert-butylphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 18830857
N-benzyl-4-cyano-N-(furan-2-ylmethyl)benzamide
CID 37429743
4-tert-butyl-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)benzamide
CID 60519774
N-benzyl-N-(furan-2-ylmethyl)-6-methoxypyridine-3-carboxamide
CID 34907486
N-benzyl-3-chloro-N-(furan-2-ylmethyl)benzamide
CID 772869
3-acetamido-N-benzyl-4-fluoro-N-(furan-2-ylmethyl)benzamide
CID 60567345
N-benzyl-N-(furan-2-ylmethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)benzamide
CID 34907635
N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide
CID 59260608
2-[(4-tert-butylphenyl)methyl-(furan-2-ylmethyl)amino]acetic acid
CID 39424492
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-4-methyl-N-propylbenzamide
CID 3596156
N-benzyl-N-(furan-2-ylmethyl)-4-(imidazol-1-ylmethyl)benzamide
CID 60542645

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide (CID 4518197) is N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide is CC(C)(C)c1ccc(C(=O)N(Cc2ccccc2)Cc2ccco2)cc1.
What is the InChIKey of N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide?
The InChIKey is GNDDFTISWPGQNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO2/c1-23(2,3)20-13-11-19(12-14-20)22(25)24(17-21-10-7-15-26-21)16-18-8-5-4-6-9-18/h4-15H,16-17H2,1-3H3.
What are the key properties of N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide?
N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide has a molecular weight of 347.46 g/mol, XLogP of 5.42, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 4518197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).