2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol

C12H19NO — CID 83698359

IUPAC2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol
SMILESCNC(C)(C)Cc1cccc(C)c1O
InChIInChI=1S/C12H19NO/c1-9-6-5-7-10(11(9)14)8-12(2,3)13-4/h5-7,13-14H,8H2,1-4H3
InChIKeyPVFXIYDUKANYSQ-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.24
Rot. Bonds3

About 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol

2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol (PubChem CID 83698359) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol.

Molecular Properties

Compound Name2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol
PubChem CID83698359
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol
SMILESCNC(C)(C)Cc1cccc(C)c1O
InChIInChI=1S/C12H19NO/c1-9-6-5-7-10(11(9)14)8-12(2,3)13-4/h5-7,13-14H,8H2,1-4H3
InChIKeyPVFXIYDUKANYSQ-UHFFFAOYSA-N
XLogP2.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,2-dimethylpropyl)-6-methylphenol
CID 22013258
2-[(2-hydroxy-3-methylphenyl)methyl]-6-methylphenol
CID 164967326
2-[[2-hydroxy-3-[(2-hydroxy-3-methylphenyl)methyl]phenyl]methyl]-6-methylphenol
CID 20768179
4-[(2-hydroxy-3-methylphenyl)methyl]-2,6-dimethylphenol
CID 22278094
2-[(4-hydroxyphenyl)methyl]-6-methylphenol
CID 91146240
2-methyl-6-[2-(methylamino)propyl]phenol
CID 14265623
2-(2,2-dimethylpropyl)-6-[[3-(2,2-dimethylpropyl)-2-hydroxyphenyl]methyl]phenol
CID 12617722
2-[[(3-hydroxy-2,2-dimethylpropyl)amino]methyl]-6-methylphenol
CID 112555005
2-methyl-6-[(2,2,3-trimethylbutylamino)methyl]phenol
CID 102673408
2-(2-bromoethyl)-6-methylphenol
CID 21464053
3-ethylbenzene-1,2-diol;3-methylbenzene-1,2-diol
CID 158712110
tris[(2-hydroxy-3-methylphenyl)methyl]-methylazanium
CID 140618052

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol?
The IUPAC name of 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol (CID 83698359) is 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol.
What is the SMILES notation for 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol?
The canonical SMILES for 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol is CNC(C)(C)Cc1cccc(C)c1O.
What is the InChIKey of 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol?
The InChIKey is PVFXIYDUKANYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-9-6-5-7-10(11(9)14)8-12(2,3)13-4/h5-7,13-14H,8H2,1-4H3.
What are the key properties of 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol?
2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol has a molecular weight of 193.29 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[2-methyl-2-(methylamino)propyl]phenol is sourced from PubChem (CID 83698359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).