N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide

C26H23NO5 — CID 28677525

IUPACN-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide
SMILESCOc1ccc(NC(=O)c2cccc(OCc3ccccc3)c2)cc1-c1ccc(CO)o1
InChIInChI=1S/C26H23NO5/c1-30-24-12-10-20(15-23(24)25-13-11-22(16-28)32-25)27-26(29)19-8-5-9-21(14-19)31-17-18-6-3-2-4-7-18/h2-15,28H,16-17H2,1H3,(H,27,29)
InChIKeyLPISZKKKJSCPJL-UHFFFAOYSA-N
MW429.47 g/mol
LogP5.28
Rot. Bonds8

About N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide

N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide (PubChem CID 28677525) has the molecular formula C26H23NO5 and a molecular weight of 429.47 g/mol. Its IUPAC name is N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide
PubChem CID28677525
Molecular FormulaC26H23NO5
Molecular Weight429.47 g/mol
Exact Mass429.16
IUPAC NameN-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide
SMILESCOc1ccc(NC(=O)c2cccc(OCc3ccccc3)c2)cc1-c1ccc(CO)o1
InChIInChI=1S/C26H23NO5/c1-30-24-12-10-20(15-23(24)25-13-11-22(16-28)32-25)27-26(29)19-8-5-9-21(14-19)31-17-18-6-3-2-4-7-18/h2-15,28H,16-17H2,1H3,(H,27,29)
InChIKeyLPISZKKKJSCPJL-UHFFFAOYSA-N
XLogP5.28
TPSA80.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500429.47
LogP ≤ 55.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-ethoxy-N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]benzamide
CID 28672132
N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-methoxybenzamide
CID 28672057
N-[4-[5-(hydroxymethyl)furan-2-yl]phenyl]-3-phenylmethoxybenzamide
CID 28677528
3-bromo-N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]benzamide
CID 28667412
N-[[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]carbamothioyl]benzamide
CID 28686845
3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
3-chloro-N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methoxyphenyl]benzamide
CID 28667496
N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methoxyphenyl]naphthalene-2-carboxamide
CID 28668742
N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methoxyphenyl]-3,5-dimethoxybenzamide
CID 28675012
3-bromo-N-[[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]carbamothioyl]benzamide
CID 28687116
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide
CID 26522423
N-[4-chloro-3-[5-(hydroxymethyl)furan-2-yl]phenyl]-3-propan-2-yloxybenzamide
CID 28672414

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide?
The IUPAC name of N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide (CID 28677525) is N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide.
What is the SMILES notation for N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide?
The canonical SMILES for N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide is COc1ccc(NC(=O)c2cccc(OCc3ccccc3)c2)cc1-c1ccc(CO)o1.
What is the InChIKey of N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide?
The InChIKey is LPISZKKKJSCPJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23NO5/c1-30-24-12-10-20(15-23(24)25-13-11-22(16-28)32-25)27-26(29)19-8-5-9-21(14-19)31-17-18-6-3-2-4-7-18/h2-15,28H,16-17H2,1H3,(H,27,29).
What are the key properties of N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide?
N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide has a molecular weight of 429.47 g/mol, XLogP of 5.28, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-(hydroxymethyl)furan-2-yl]-4-methoxyphenyl]-3-phenylmethoxybenzamide is sourced from PubChem (CID 28677525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).