N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide

C19H23NO3 — CID 141451288

IUPACN,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide
SMILESCCN(CC)C(=O)c1ccccc1OCc1ccc(CO)cc1
InChIInChI=1S/C19H23NO3/c1-3-20(4-2)19(22)17-7-5-6-8-18(17)23-14-16-11-9-15(13-21)10-12-16/h5-12,21H,3-4,13-14H2,1-2H3
InChIKeyWAMPYZCMPUAOMP-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.24
Rot. Bonds7

About N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide

N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide (PubChem CID 141451288) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide.

Molecular Properties

Compound NameN,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide
PubChem CID141451288
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide
SMILESCCN(CC)C(=O)c1ccccc1OCc1ccc(CO)cc1
InChIInChI=1S/C19H23NO3/c1-3-20(4-2)19(22)17-7-5-6-8-18(17)23-14-16-11-9-15(13-21)10-12-16/h5-12,21H,3-4,13-14H2,1-2H3
InChIKeyWAMPYZCMPUAOMP-UHFFFAOYSA-N
XLogP3.24
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide
CID 13073631
2-[(2-chlorophenyl)methoxy]-N,N-diethylbenzamide
CID 13073609
2-[(2-bromophenyl)methoxy]-N,N-diethylbenzamide
CID 112762956
2-(chloromethoxy)-N,N-diethylbenzamide;hydrochloride
CID 173020221
5-chloro-N,N-diethyl-2-phenylmethoxybenzamide
CID 8799985
4-[(2-chlorophenoxy)methyl]-N,N-diethylbenzamide
CID 892992
methyl 2-[[4-[(2-methoxycarbonylphenoxy)methyl]phenyl]methoxy]benzoate
CID 14323673
[4-[(2-propoxyphenoxy)methyl]phenyl]methanol
CID 115969538
[2-(diethylcarbamoyl)phenyl] N,N-dimethylcarbamate
CID 122517571
N-(2-chloroethyl)-2-ethoxy-N-ethylbenzamide
CID 63395258
N,N-diethyl-4-[(2-phenylmethoxyphenyl)-piperidin-4-ylidenemethyl]benzamide
CID 11293990
[2-(diethylcarbamoyl)phenyl] N,N-dipropylcarbamate
CID 122517572

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide?
The IUPAC name of N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide (CID 141451288) is N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide.
What is the SMILES notation for N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide?
The canonical SMILES for N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide is CCN(CC)C(=O)c1ccccc1OCc1ccc(CO)cc1.
What is the InChIKey of N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide?
The InChIKey is WAMPYZCMPUAOMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-3-20(4-2)19(22)17-7-5-6-8-18(17)23-14-16-11-9-15(13-21)10-12-16/h5-12,21H,3-4,13-14H2,1-2H3.
What are the key properties of N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide?
N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide has a molecular weight of 313.40 g/mol, XLogP of 3.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide is sourced from PubChem (CID 141451288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).