1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol

C14H23NO — CID 62773393

IUPAC1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol
SMILESCCNCC(C)(O)c1c(C)cc(C)cc1C
InChIInChI=1S/C14H23NO/c1-6-15-9-14(5,16)13-11(3)7-10(2)8-12(13)4/h7-8,15-16H,6,9H2,1-5H3
InChIKeyLLMZNXISAZRTCJ-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.43
Rot. Bonds4

About 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol

1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol (PubChem CID 62773393) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol.

Molecular Properties

Compound Name1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol
PubChem CID62773393
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol
SMILESCCNCC(C)(O)c1c(C)cc(C)cc1C
InChIInChI=1S/C14H23NO/c1-6-15-9-14(5,16)13-11(3)7-10(2)8-12(13)4/h7-8,15-16H,6,9H2,1-5H3
InChIKeyLLMZNXISAZRTCJ-UHFFFAOYSA-N
XLogP2.43
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4,6-trimethylphenyl)butan-2-ol
CID 91656781
1-(ethylamino)-2-(2,4,5-trimethylphenyl)propan-2-ol
CID 66039376
1-(ethylamino)-2-(3-fluoro-5-methylphenyl)propan-2-ol
CID 79704574
2-(2,6-difluoro-3-methylphenyl)-1-(ethylamino)propan-2-ol
CID 82828009
1-(2,4-dimethylphenoxy)-3-(ethylamino)-2-methylpropan-2-ol
CID 66336681
2-(4-tert-butylphenyl)-1-(ethylamino)propan-2-ol
CID 62773195
ethyl 4-hydroxy-4-(2,4,6-trimethylphenyl)pentanoate
CID 66321481
N-(bromomethyl)-2-methyl-2-(2,4,6-trimethylphenyl)propan-1-amine
CID 115262537
N'-[2-methyl-2-(2,4,6-trimethylphenyl)propyl]methanediamine
CID 115226366
2-(3-bromo-2,6-difluorophenyl)-1-(ethylamino)propan-2-ol
CID 106943818
1-[[2-methyl-2-(2,4,6-trimethylphenyl)propyl]amino]propan-2-one
CID 115235277
2-methyl-1-N-[2-methyl-2-(2,4,6-trimethylphenyl)propyl]propane-1,2-diamine
CID 115136351

Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol?
The IUPAC name of 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol (CID 62773393) is 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol.
What is the SMILES notation for 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol?
The canonical SMILES for 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol is CCNCC(C)(O)c1c(C)cc(C)cc1C.
What is the InChIKey of 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol?
The InChIKey is LLMZNXISAZRTCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-6-15-9-14(5,16)13-11(3)7-10(2)8-12(13)4/h7-8,15-16H,6,9H2,1-5H3.
What are the key properties of 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol?
1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol has a molecular weight of 221.34 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-2-(2,4,6-trimethylphenyl)propan-2-ol is sourced from PubChem (CID 62773393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).