N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide

C16H25NO3 — CID 131938327

IUPACN-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide
SMILESCCOc1ccc(CN(CC)C(=O)C(CC)OC)cc1
InChIInChI=1S/C16H25NO3/c1-5-15(19-4)16(18)17(6-2)12-13-8-10-14(11-9-13)20-7-3/h8-11,15H,5-7,12H2,1-4H3
InChIKeyBCGPDMRQKRPLPJ-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.86
Rot. Bonds8

About N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide

N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide (PubChem CID 131938327) has the molecular formula C16H25NO3 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide.

Molecular Properties

Compound NameN-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide
PubChem CID131938327
Molecular FormulaC16H25NO3
Molecular Weight279.38 g/mol
Exact Mass279.18
IUPAC NameN-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide
SMILESCCOc1ccc(CN(CC)C(=O)C(CC)OC)cc1
InChIInChI=1S/C16H25NO3/c1-5-15(19-4)16(18)17(6-2)12-13-8-10-14(11-9-13)20-7-3/h8-11,15H,5-7,12H2,1-4H3
InChIKeyBCGPDMRQKRPLPJ-UHFFFAOYSA-N
XLogP2.86
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide 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-[(4-ethoxyphenyl)methyl]-2-ethyl-N-methylbutanamide
CID 78780749
2-(aminomethyl)-N-ethyl-N-[(4-methoxyphenyl)methyl]butanamide
CID 65227293
(2R)-2-amino-N-[(4-ethoxyphenyl)methyl]-N-methylpropanamide;hydrochloride
CID 119266766
(2S)-2-amino-N-ethyl-N-[(4-methoxyphenyl)methyl]-3-methylbutanamide
CID 61163391
N-[(3,4-dimethoxyphenyl)methyl]-2-(4-ethoxyphenyl)-N-ethylacetamide
CID 78808317
(2S)-2-amino-N-ethyl-N-[(4-methoxyphenyl)methyl]pentanamide
CID 93372926
1-(difluoromethyl)-N-[(4-ethoxyphenyl)methyl]-N-ethylpyrazole-3-carboxamide
CID 131896834
2-(4-ethoxyanilino)-N,N-diethylbutanamide
CID 3027706
4-[(4-ethoxyphenyl)methyl-methylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103497496
4-amino-N-ethyl-N-[(4-methoxyphenyl)methyl]pentanamide;hydrochloride
CID 120560791
N-[(4-ethoxyphenyl)methyl]-N-methylpropan-2-amine
CID 78815360
methyl N-[(2R)-2-[(4-ethoxyphenyl)methyl-methylamino]propanoyl]carbamate
CID 8695096

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide?
The IUPAC name of N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide (CID 131938327) is N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide.
What is the SMILES notation for N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide?
The canonical SMILES for N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide is CCOc1ccc(CN(CC)C(=O)C(CC)OC)cc1.
What is the InChIKey of N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide?
The InChIKey is BCGPDMRQKRPLPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3/c1-5-15(19-4)16(18)17(6-2)12-13-8-10-14(11-9-13)20-7-3/h8-11,15H,5-7,12H2,1-4H3.
What are the key properties of N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide?
N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide has a molecular weight of 279.38 g/mol, XLogP of 2.86, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethoxyphenyl)methyl]-N-ethyl-2-methoxybutanamide is sourced from PubChem (CID 131938327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).