4-(diethylaminomethyl)-N-phenylmethoxybenzamide

C19H24N2O2 — CID 38036519

IUPAC4-(diethylaminomethyl)-N-phenylmethoxybenzamide
SMILESCCN(CC)Cc1ccc(C(=O)NOCc2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-3-21(4-2)14-16-10-12-18(13-11-16)19(22)20-23-15-17-8-6-5-7-9-17/h5-13H,3-4,14-15H2,1-2H3,(H,20,22)
InChIKeyDBKYNPLCJAYRFL-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.39
Rot. Bonds8

About 4-(diethylaminomethyl)-N-phenylmethoxybenzamide

4-(diethylaminomethyl)-N-phenylmethoxybenzamide (PubChem CID 38036519) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 4-(diethylaminomethyl)-N-phenylmethoxybenzamide.

Molecular Properties

Compound Name4-(diethylaminomethyl)-N-phenylmethoxybenzamide
PubChem CID38036519
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name4-(diethylaminomethyl)-N-phenylmethoxybenzamide
SMILESCCN(CC)Cc1ccc(C(=O)NOCc2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-3-21(4-2)14-16-10-12-18(13-11-16)19(22)20-23-15-17-8-6-5-7-9-17/h5-13H,3-4,14-15H2,1-2H3,(H,20,22)
InChIKeyDBKYNPLCJAYRFL-UHFFFAOYSA-N
XLogP3.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-phenyl-N-phenylmethoxybenzamide
CID 9227272
4-(phenoxymethyl)-N-phenylmethoxybenzamide
CID 41450965
N-[(4-methylphenyl)methoxy]benzamide
CID 2366824
4-bromo-N-phenylmethoxybenzamide
CID 41450559
[4-(phenylmethoxycarbamoyl)phenyl]methylcarbamic acid
CID 87545095
benzoic acid;N-benzyl-N-ethylethanamine
CID 86113086
4-(diethylaminomethyl)-N-(2-phenylethenyl)benzamide
CID 174341683
3,4-dihydroxy-N-phenylmethoxybenzamide
CID 91664812
4-[[ethyl(2-hydroxyethyl)amino]methyl]benzohydrazide
CID 63572832
6-methyl-N-phenylmethoxypyridine-3-carboxamide
CID 18149129
N-(benzylideneamino)-4-(diethylaminomethyl)benzamide
CID 165351037
3-(methylsulfanylmethyl)-N-phenylmethoxybenzamide
CID 30796114

Frequently Asked Questions

What is the IUPAC name of 4-(diethylaminomethyl)-N-phenylmethoxybenzamide?
The IUPAC name of 4-(diethylaminomethyl)-N-phenylmethoxybenzamide (CID 38036519) is 4-(diethylaminomethyl)-N-phenylmethoxybenzamide.
What is the SMILES notation for 4-(diethylaminomethyl)-N-phenylmethoxybenzamide?
The canonical SMILES for 4-(diethylaminomethyl)-N-phenylmethoxybenzamide is CCN(CC)Cc1ccc(C(=O)NOCc2ccccc2)cc1.
What is the InChIKey of 4-(diethylaminomethyl)-N-phenylmethoxybenzamide?
The InChIKey is DBKYNPLCJAYRFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-3-21(4-2)14-16-10-12-18(13-11-16)19(22)20-23-15-17-8-6-5-7-9-17/h5-13H,3-4,14-15H2,1-2H3,(H,20,22).
What are the key properties of 4-(diethylaminomethyl)-N-phenylmethoxybenzamide?
4-(diethylaminomethyl)-N-phenylmethoxybenzamide has a molecular weight of 312.41 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylaminomethyl)-N-phenylmethoxybenzamide is sourced from PubChem (CID 38036519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).