N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide

C26H23NO3 — CID 59260608

IUPACN-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide
SMILESCOc1ccc(-c2ccc(CN(Cc3ccco3)C(=O)c3ccccc3)cc2)cc1
InChIInChI=1S/C26H23NO3/c1-29-24-15-13-22(14-16-24)21-11-9-20(10-12-21)18-27(19-25-8-5-17-30-25)26(28)23-6-3-2-4-7-23/h2-17H,18-19H2,1H3
InChIKeyTYZBCDAOQARTLG-UHFFFAOYSA-N
MW397.47 g/mol
LogP5.80
Rot. Bonds7

About N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide

N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide (PubChem CID 59260608) has the molecular formula C26H23NO3 and a molecular weight of 397.47 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide
PubChem CID59260608
Molecular FormulaC26H23NO3
Molecular Weight397.47 g/mol
Exact Mass397.17
IUPAC NameN-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide
SMILESCOc1ccc(-c2ccc(CN(Cc3ccco3)C(=O)c3ccccc3)cc2)cc1
InChIInChI=1S/C26H23NO3/c1-29-24-15-13-22(14-16-24)21-11-9-20(10-12-21)18-27(19-25-8-5-17-30-25)26(28)23-6-3-2-4-7-23/h2-17H,18-19H2,1H3
InChIKeyTYZBCDAOQARTLG-UHFFFAOYSA-N
XLogP5.80
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.47
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[[furan-2-ylmethyl-(4-methoxybenzoyl)amino]methyl]phenyl] methanesulfonate
CID 3367007
N,N-bis(furan-2-ylmethyl)-2-(4-methoxyphenyl)acetamide
CID 52548109
N-benzyl-N-(furan-2-ylmethyl)-6-methoxypyridine-3-carboxamide
CID 34907486
ethyl 2-[furan-2-ylmethyl-[(4-methoxyphenyl)methyl]amino]-2-oxoacetate
CID 3847451
N-benzyl-4-tert-butyl-N-(furan-2-ylmethyl)benzamide
CID 4518197
N-(furan-2-ylmethyl)-N-[(3-phenoxyphenyl)methyl]benzamide
CID 42705565
N-benzyl-N-(furan-2-ylmethyl)-4-pentylbenzamide
CID 4518534
N-benzyl-N-(furan-2-ylmethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)benzamide
CID 34907635
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-N-(2-methoxyethyl)benzamide
CID 42773009
N-(1,3-benzodioxol-5-ylmethyl)-N-(furan-2-ylmethyl)-3,5-dimethoxybenzamide
CID 42724577
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-N-(3-methoxypropyl)-4-phenylbenzamide
CID 5166760
N-benzyl-3-chloro-N-(furan-2-ylmethyl)benzamide
CID 772869

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide (CID 59260608) is N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide is COc1ccc(-c2ccc(CN(Cc3ccco3)C(=O)c3ccccc3)cc2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide?
The InChIKey is TYZBCDAOQARTLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23NO3/c1-29-24-15-13-22(14-16-24)21-11-9-20(10-12-21)18-27(19-25-8-5-17-30-25)26(28)23-6-3-2-4-7-23/h2-17H,18-19H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide?
N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide has a molecular weight of 397.47 g/mol, XLogP of 5.80, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide is sourced from PubChem (CID 59260608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).