4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol

C15H25NO3 — CID 82986315

IUPAC4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol
SMILESCCC(C)N(CCOC)Cc1ccc(O)c(OC)c1
InChIInChI=1S/C15H25NO3/c1-5-12(2)16(8-9-18-3)11-13-6-7-14(17)15(10-13)19-4/h6-7,10,12,17H,5,8-9,11H2,1-4H3
InChIKeyZHFQBGGQWITUFK-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.65
Rot. Bonds8

About 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol

4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol (PubChem CID 82986315) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol.

Molecular Properties

Compound Name4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol
PubChem CID82986315
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol
SMILESCCC(C)N(CCOC)Cc1ccc(O)c(OC)c1
InChIInChI=1S/C15H25NO3/c1-5-12(2)16(8-9-18-3)11-13-6-7-14(17)15(10-13)19-4/h6-7,10,12,17H,5,8-9,11H2,1-4H3
InChIKeyZHFQBGGQWITUFK-UHFFFAOYSA-N
XLogP2.65
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol 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-bromo-4-[[butan-2-yl(2-methoxyethyl)amino]methyl]phenol
CID 82985781
N-[(3-bromo-4-methoxyphenyl)methyl]-N-(2-methoxyethyl)butan-2-amine
CID 54942276
2-ethoxy-4-[[2-methoxyethyl(propan-2-yl)amino]methyl]phenol
CID 82983167
2-ethoxy-4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]phenol
CID 82958280
2-bromo-4-[[2-methoxyethyl(pentan-3-yl)amino]methyl]phenol
CID 82986263
N-[[4-(aminomethyl)phenyl]methyl]-N-(2-methoxyethyl)butan-2-amine
CID 55001040
2,6-dibromo-4-[[butan-2-yl(2-methoxyethyl)amino]methyl]phenol
CID 107740294
2-[4-[[butan-2-yl(2-methoxyethyl)amino]methyl]phenyl]acetic acid
CID 105345880
4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol
CID 82977222
5-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-fluorobenzoic acid
CID 107880751
4-[[3-(diethylamino)propyl-ethylamino]methyl]-2-methoxyphenol
CID 102999096
N-(2-methoxyethyl)-N-[[4-[(propan-2-ylamino)methyl]phenyl]methyl]butan-2-amine
CID 62463675

Frequently Asked Questions

What is the IUPAC name of 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol?
The IUPAC name of 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol (CID 82986315) is 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol.
What is the SMILES notation for 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol?
The canonical SMILES for 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol is CCC(C)N(CCOC)Cc1ccc(O)c(OC)c1.
What is the InChIKey of 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol?
The InChIKey is ZHFQBGGQWITUFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-5-12(2)16(8-9-18-3)11-13-6-7-14(17)15(10-13)19-4/h6-7,10,12,17H,5,8-9,11H2,1-4H3.
What are the key properties of 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol?
4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol has a molecular weight of 267.37 g/mol, XLogP of 2.65, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol is sourced from PubChem (CID 82986315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).