5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol

C12H19NO — CID 83698360

IUPAC5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol
SMILESCNCC(C)(C)c1ccc(C)cc1O
InChIInChI=1S/C12H19NO/c1-9-5-6-10(11(14)7-9)12(2,3)8-13-4/h5-7,13-14H,8H2,1-4H3
InChIKeyLYABHZCNAYLNQP-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.20
Rot. Bonds3

About 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol

5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol (PubChem CID 83698360) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol.

Molecular Properties

Compound Name5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol
PubChem CID83698360
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol
SMILESCNCC(C)(C)c1ccc(C)cc1O
InChIInChI=1S/C12H19NO/c1-9-5-6-10(11(14)7-9)12(2,3)8-13-4/h5-7,13-14H,8H2,1-4H3
InChIKeyLYABHZCNAYLNQP-UHFFFAOYSA-N
XLogP2.20
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 ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 83698847
2-[(2S)-2-amino-1-hydroxypropan-2-yl]-5-methylphenol
CID 130715029
2-N-[2-(2,5-dimethylphenyl)-2-methylpropyl]-1-N,2-dimethylpropane-1,2-diamine
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2-[2-(3,5-dimethylphenyl)but-3-en-2-yl]-5-methylphenol
CID 54425254
N'-[2-(2,5-dimethylphenyl)-2-methylpropyl]-N-methylmethanediamine
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[2-(2,4-dimethylphenyl)-2-methylpropyl]carbamic acid
CID 115171380
5-methyl-2-[1-[(2-methyl-2-phenylpropyl)amino]ethyl]phenol
CID 60988135
N-[2-(2,4-dimethylphenyl)-2-methylpropyl]acetamide
CID 115191406
4-methoxy-3-[2-methyl-1-(methylamino)propan-2-yl]phenol
CID 105425938
2-(2,5-dimethylphenyl)-1-(methylamino)butan-2-ol
CID 82040151
4-methyl-2-(2,4,4-trimethylpentan-2-yl)phenol
CID 521263
2,6-dihydroxy-2-(2-hydroxy-4-methylphenyl)-6-methylhept-4-en-3-one
CID 74493494

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol?
The IUPAC name of 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol (CID 83698360) is 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol.
What is the SMILES notation for 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol?
The canonical SMILES for 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol is CNCC(C)(C)c1ccc(C)cc1O.
What is the InChIKey of 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol?
The InChIKey is LYABHZCNAYLNQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-9-5-6-10(11(14)7-9)12(2,3)8-13-4/h5-7,13-14H,8H2,1-4H3.
What are the key properties of 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol?
5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol has a molecular weight of 193.29 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[2-methyl-1-(methylamino)propan-2-yl]phenol is sourced from PubChem (CID 83698360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).