N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide

C21H19NO3 — CID 110006010

IUPACN-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide
SMILESO=C(Nc1cccc(OCc2ccc(CO)cc2)c1)c1ccccc1
InChIInChI=1S/C21H19NO3/c23-14-16-9-11-17(12-10-16)15-25-20-8-4-7-19(13-20)22-21(24)18-5-2-1-3-6-18/h1-13,23H,14-15H2,(H,22,24)
InChIKeyWIXQIEYVARDBLY-UHFFFAOYSA-N
MW333.39 g/mol
LogP4.01
Rot. Bonds6

About N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide

N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide (PubChem CID 110006010) has the molecular formula C21H19NO3 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide.

Molecular Properties

Compound NameN-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide
PubChem CID110006010
Molecular FormulaC21H19NO3
Molecular Weight333.39 g/mol
Exact Mass333.14
IUPAC NameN-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide
SMILESO=C(Nc1cccc(OCc2ccc(CO)cc2)c1)c1ccccc1
InChIInChI=1S/C21H19NO3/c23-14-16-9-11-17(12-10-16)15-25-20-8-4-7-19(13-20)22-21(24)18-5-2-1-3-6-18/h1-13,23H,14-15H2,(H,22,24)
InChIKeyWIXQIEYVARDBLY-UHFFFAOYSA-N
XLogP4.01
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-phenoxyethoxy)-N-(3-phenylmethoxyphenyl)benzamide
CID 17086099
3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
N-[4-(phenoxymethyl)phenyl]benzamide
CID 141092226
4-phenylmethoxy-N-(3-prop-2-enoxyphenyl)benzamide
CID 17086755
N-(3-phenylmethoxyphenyl)-4-propoxybenzamide
CID 17086082
3-phenylmethoxy-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
CID 33498503
3-[(4-phenylmethoxybenzoyl)amino]benzamide
CID 78779054
3-[[4-[(4-fluorophenyl)methoxy]benzoyl]amino]benzoic acid
CID 139501079
N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide
CID 153407823
N-(3,4-dichlorophenyl)-3-phenylmethoxybenzamide
CID 17148514
N-[3-(3-methoxypropoxy)phenyl]benzamide
CID 86997539
4-[(3-acetamidophenoxy)methyl]benzoic acid
CID 28829525

Frequently Asked Questions

What is the IUPAC name of N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide?
The IUPAC name of N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide (CID 110006010) is N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide.
What is the SMILES notation for N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide?
The canonical SMILES for N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide is O=C(Nc1cccc(OCc2ccc(CO)cc2)c1)c1ccccc1.
What is the InChIKey of N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide?
The InChIKey is WIXQIEYVARDBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO3/c23-14-16-9-11-17(12-10-16)15-25-20-8-4-7-19(13-20)22-21(24)18-5-2-1-3-6-18/h1-13,23H,14-15H2,(H,22,24).
What are the key properties of N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide?
N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide has a molecular weight of 333.39 g/mol, XLogP of 4.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide is sourced from PubChem (CID 110006010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).