2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol

C15H25NO2 — CID 115133609

IUPAC2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol
SMILESCOc1c(C)cc(CCNC(C)(C)CO)cc1C
InChIInChI=1S/C15H25NO2/c1-11-8-13(9-12(2)14(11)18-5)6-7-16-15(3,4)10-17/h8-9,16-17H,6-7,10H2,1-5H3
InChIKeyQSLPNMOAONSBDP-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.22
Rot. Bonds6

About 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol

2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol (PubChem CID 115133609) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol
PubChem CID115133609
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol
SMILESCOc1c(C)cc(CCNC(C)(C)CO)cc1C
InChIInChI=1S/C15H25NO2/c1-11-8-13(9-12(2)14(11)18-5)6-7-16-15(3,4)10-17/h8-9,16-17H,6-7,10H2,1-5H3
InChIKeyQSLPNMOAONSBDP-UHFFFAOYSA-N
XLogP2.22
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-methoxy-3,5-dimethylphenyl)methylamino]-2-methylpropan-1-ol
CID 111112626
[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]methanol
CID 115229389
2-[(4-methoxy-3,5-dimethylphenyl)methylamino]-2-methylpropane-1,3-diol
CID 84597784
4-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]butan-1-ol
CID 115217828
2-[2-(3-bromo-4-methoxyphenyl)ethylamino]-2-methylpropan-1-ol
CID 115133534
2-(4-methoxy-3,5-dimethylphenyl)ethylurea
CID 115168574
3-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]propane-1,2-diol
CID 115122359
1-[2-(4-methoxy-3,5-dimethylphenyl)ethyl]-3-methylurea
CID 115169411
2-(3-tert-butyl-4-methoxy-5-methylphenyl)-N-methylethanamine
CID 117343656
4-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]butan-2-one
CID 115235985
3-[[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]methyl]cyclobutan-1-amine
CID 115214323
N-[(4-methoxy-3,5-dimethylphenyl)methyl]-N-methylhydroxylamine
CID 82606327

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol?
The IUPAC name of 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol (CID 115133609) is 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol.
What is the SMILES notation for 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol?
The canonical SMILES for 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol is COc1c(C)cc(CCNC(C)(C)CO)cc1C.
What is the InChIKey of 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol?
The InChIKey is QSLPNMOAONSBDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-11-8-13(9-12(2)14(11)18-5)6-7-16-15(3,4)10-17/h8-9,16-17H,6-7,10H2,1-5H3.
What are the key properties of 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol?
2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol has a molecular weight of 251.37 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methoxy-3,5-dimethylphenyl)ethylamino]-2-methylpropan-1-ol is sourced from PubChem (CID 115133609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).