N-benzyl-3-ethoxy-4-propoxybenzamide

C19H23NO3 — CID 4264811

IUPACN-benzyl-3-ethoxy-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)NCc2ccccc2)cc1OCC
InChIInChI=1S/C19H23NO3/c1-3-12-23-17-11-10-16(13-18(17)22-4-2)19(21)20-14-15-8-6-5-7-9-15/h5-11,13H,3-4,12,14H2,1-2H3,(H,20,21)
InChIKeyQUVYBUASEVPNEV-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.80
Rot. Bonds8

About N-benzyl-3-ethoxy-4-propoxybenzamide

N-benzyl-3-ethoxy-4-propoxybenzamide (PubChem CID 4264811) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-benzyl-3-ethoxy-4-propoxybenzamide.

Molecular Properties

Compound NameN-benzyl-3-ethoxy-4-propoxybenzamide
PubChem CID4264811
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-benzyl-3-ethoxy-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)NCc2ccccc2)cc1OCC
InChIInChI=1S/C19H23NO3/c1-3-12-23-17-11-10-16(13-18(17)22-4-2)19(21)20-14-15-8-6-5-7-9-15/h5-11,13H,3-4,12,14H2,1-2H3,(H,20,21)
InChIKeyQUVYBUASEVPNEV-UHFFFAOYSA-N
XLogP3.80
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-benzyl-3-ethoxy-4-propoxybenzamide 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

N-benzyl-3-ethoxy-4-phenylmethoxybenzamide
CID 2192321
N-benzyl-3-ethoxy-5-iodo-4-propoxybenzamide
CID 3971537
N-[4-(benzylcarbamoyl)phenyl]-3-bromo-4-propoxybenzamide
CID 28639983
N-(2-aminoethyl)-3-ethoxy-4-propoxybenzamide
CID 119384376
3,4-diethoxy-N-[(2-ethoxyphenyl)methyl]benzamide
CID 71822422
N-(3-aminobutyl)-3-ethoxy-4-propoxybenzamide
CID 119498085
N'-benzoyl-3,4-dipropoxybenzohydrazide
CID 8574890
3-ethoxy-N-[[2-[[methyl(propan-2-yl)amino]methyl]phenyl]methyl]-4-propoxybenzamide
CID 46456160
3-ethoxy-4-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]benzamide
CID 39508576
4-[[(3-ethoxy-4-propoxyphenyl)methylamino]methyl]benzoic acid
CID 29227556
N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dipropoxybenzohydrazide
CID 55358632
N'-(3-ethoxy-4-propoxybenzoyl)furan-2-carbohydrazide
CID 9476415

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-ethoxy-4-propoxybenzamide?
The IUPAC name of N-benzyl-3-ethoxy-4-propoxybenzamide (CID 4264811) is N-benzyl-3-ethoxy-4-propoxybenzamide.
What is the SMILES notation for N-benzyl-3-ethoxy-4-propoxybenzamide?
The canonical SMILES for N-benzyl-3-ethoxy-4-propoxybenzamide is CCCOc1ccc(C(=O)NCc2ccccc2)cc1OCC.
What is the InChIKey of N-benzyl-3-ethoxy-4-propoxybenzamide?
The InChIKey is QUVYBUASEVPNEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-3-12-23-17-11-10-16(13-18(17)22-4-2)19(21)20-14-15-8-6-5-7-9-15/h5-11,13H,3-4,12,14H2,1-2H3,(H,20,21).
What are the key properties of N-benzyl-3-ethoxy-4-propoxybenzamide?
N-benzyl-3-ethoxy-4-propoxybenzamide has a molecular weight of 313.40 g/mol, XLogP of 3.80, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-ethoxy-4-propoxybenzamide is sourced from PubChem (CID 4264811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).