4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol

C14H23NO2 — CID 82977222

IUPAC4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol
SMILESCCN(Cc1ccc(O)c(OC)c1)CC(C)C
InChIInChI=1S/C14H23NO2/c1-5-15(9-11(2)3)10-12-6-7-13(16)14(8-12)17-4/h6-8,11,16H,5,9-10H2,1-4H3
InChIKeyUVKDBCBSSUGYIP-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.88
Rot. Bonds6

About 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol

4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol (PubChem CID 82977222) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol.

Molecular Properties

Compound Name4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol
PubChem CID82977222
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol
SMILESCCN(Cc1ccc(O)c(OC)c1)CC(C)C
InChIInChI=1S/C14H23NO2/c1-5-15(9-11(2)3)10-12-6-7-13(16)14(8-12)17-4/h6-8,11,16H,5,9-10H2,1-4H3
InChIKeyUVKDBCBSSUGYIP-UHFFFAOYSA-N
XLogP2.88
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[3-(diethylamino)propyl-ethylamino]methyl]-2-methoxyphenol
CID 102999096
4-[[bis(2-methylpropyl)amino]methyl]-2-ethoxyphenol
CID 82982111
N-[[3-(aminomethyl)-4-methoxyphenyl]methyl]-N-ethyl-2-methylpropan-1-amine
CID 65340694
4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxybenzenecarboximidamide
CID 106790577
3-[5-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenyl]prop-2-enoic acid
CID 76908220
1-[(3,4-dimethoxyphenyl)methyl-(2-methylpropyl)amino]-2-methylpropan-2-ol
CID 24714459
3-[(3,4-dimethoxyphenyl)methyl-ethylamino]-2-methylpropanenitrile
CID 54943422
4-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methoxyphenol
CID 82986315
[4-[[ethyl(2-methylpropyl)amino]methyl]phenyl]methanol
CID 112631179
ethane;2-methoxy-4-propylphenol
CID 144852330
2-ethoxy-4-[[methyl(2-methylpropyl)amino]methyl]phenol
CID 82976727
N-[(4-hydroxy-3-methoxyphenyl)methyl]-N,2-dimethylpropanamide
CID 64592034

Frequently Asked Questions

What is the IUPAC name of 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol?
The IUPAC name of 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol (CID 82977222) is 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol.
What is the SMILES notation for 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol?
The canonical SMILES for 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol is CCN(Cc1ccc(O)c(OC)c1)CC(C)C.
What is the InChIKey of 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol?
The InChIKey is UVKDBCBSSUGYIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-5-15(9-11(2)3)10-12-6-7-13(16)14(8-12)17-4/h6-8,11,16H,5,9-10H2,1-4H3.
What are the key properties of 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol?
4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol has a molecular weight of 237.34 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[ethyl(2-methylpropyl)amino]methyl]-2-methoxyphenol is sourced from PubChem (CID 82977222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).