2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide

C15H24N2O4 — CID 82959006

IUPAC2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide
SMILESCCCCN(CC(N)=O)Cc1cc(OC)c(O)c(OC)c1
InChIInChI=1S/C15H24N2O4/c1-4-5-6-17(10-14(16)18)9-11-7-12(20-2)15(19)13(8-11)21-3/h7-8,19H,4-6,9-10H2,1-3H3,(H2,16,18)
InChIKeyDSFGVTXYGVUIBQ-UHFFFAOYSA-N
MW296.37 g/mol
LogP1.50
Rot. Bonds9

About 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide

2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide (PubChem CID 82959006) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide.

Molecular Properties

Compound Name2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide
PubChem CID82959006
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide
SMILESCCCCN(CC(N)=O)Cc1cc(OC)c(O)c(OC)c1
InChIInChI=1S/C15H24N2O4/c1-4-5-6-17(10-14(16)18)9-11-7-12(20-2)15(19)13(8-11)21-3/h7-8,19H,4-6,9-10H2,1-3H3,(H2,16,18)
InChIKeyDSFGVTXYGVUIBQ-UHFFFAOYSA-N
XLogP1.50
TPSA85.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide 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

2-[butyl-[(3,5-dibromo-4-hydroxyphenyl)methyl]amino]acetamide
CID 107740264
2-[(3-bromo-4-methoxyphenyl)methyl-butylamino]acetamide
CID 54942215
4-[(dipropylamino)methyl]-2,6-dimethoxyphenol;hydrochloride
CID 45259533
2-[[4-(aminomethyl)-3-methoxyphenyl]methyl-(2-amino-2-oxoethyl)amino]acetamide
CID 106785478
heptyl 2-[2-[(2-heptoxy-2-oxoethyl)-[(3,4,5-trimethoxyphenyl)methyl]amino]ethyl-[(3,4,5-trimethoxyphenyl)methyl]amino]acetate
CID 10604988
2-[butyl-[(2-hydroxyphenyl)methyl]amino]acetamide
CID 82978056
2-[butyl-[[4-(2-hydrazinyl-2-oxoethyl)phenyl]methyl]amino]acetamide
CID 105351844
2,6-dimethoxy-4-pentylphenol
CID 22625510
4-[(dimethylamino)methyl]-2,6-dimethoxyphenol
CID 10066574
2-[(3-aminophenyl)methyl-octylamino]acetamide
CID 43461268
N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]butan-1-amine
CID 3537775
2-[(4-amino-3-nitrophenyl)methyl-butylamino]acetamide
CID 62184585

Frequently Asked Questions

What is the IUPAC name of 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide?
The IUPAC name of 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide (CID 82959006) is 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide.
What is the SMILES notation for 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide?
The canonical SMILES for 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide is CCCCN(CC(N)=O)Cc1cc(OC)c(O)c(OC)c1.
What is the InChIKey of 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide?
The InChIKey is DSFGVTXYGVUIBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-4-5-6-17(10-14(16)18)9-11-7-12(20-2)15(19)13(8-11)21-3/h7-8,19H,4-6,9-10H2,1-3H3,(H2,16,18).
What are the key properties of 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide?
2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide has a molecular weight of 296.37 g/mol, XLogP of 1.50, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]amino]acetamide is sourced from PubChem (CID 82959006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).