2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol

C15H25NO3 — CID 115133353

IUPAC2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol
SMILESCOc1cc(N(C)C(C)(C)CO)c(OC)c(C)c1C
InChIInChI=1S/C15H25NO3/c1-10-11(2)14(19-7)12(8-13(10)18-6)16(5)15(3,4)9-17/h8,17H,9H2,1-7H3
InChIKeyHXXHTEMHKJWRID-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.53
Rot. Bonds5

About 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol

2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol (PubChem CID 115133353) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol
PubChem CID115133353
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol
SMILESCOc1cc(N(C)C(C)(C)CO)c(OC)c(C)c1C
InChIInChI=1S/C15H25NO3/c1-10-11(2)14(19-7)12(8-13(10)18-6)16(5)15(3,4)9-17/h8,17H,9H2,1-7H3
InChIKeyHXXHTEMHKJWRID-UHFFFAOYSA-N
XLogP2.53
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-2-(3,4,5-trimethoxy-N-methylanilino)propan-1-ol
CID 115133331
2-(2-methoxy-N,5-dimethylanilino)-2-methylpropan-1-ol
CID 115133221
1-N-(2,5-dimethoxy-3,4-dimethylphenyl)-1-N,2-dimethylpropane-1,2-diamine
CID 115135839
N-ethyl-2,5-dimethoxy-N,3,4-trimethylaniline
CID 115259380
N'-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-methylmethanediamine
CID 115225660
2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpropan-1-ol
CID 117349580
2-(2,5-dimethoxy-N,3,4-trimethylanilino)ethanethiol
CID 115223892
methyl 2-(2,5-dimethoxy-N,3,4-trimethylanilino)acetate
CID 115232849
2-N-(4-methoxy-2,3,5-trimethylphenyl)-1-N,2-N,2-trimethylpropane-1,2-diamine
CID 115132578
1-(2,5-dimethoxy-3,4-dimethylphenyl)-2-methylpropan-2-ol
CID 116928719
1-[2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]-6-methoxyphenyl]ethanone
CID 113475776
2-N-(4-methoxy-2,3,5-trimethylphenyl)-2-N,2-dimethylpropane-1,2-diamine
CID 115131786

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol?
The IUPAC name of 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol (CID 115133353) is 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol.
What is the SMILES notation for 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol?
The canonical SMILES for 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol is COc1cc(N(C)C(C)(C)CO)c(OC)c(C)c1C.
What is the InChIKey of 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol?
The InChIKey is HXXHTEMHKJWRID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-10-11(2)14(19-7)12(8-13(10)18-6)16(5)15(3,4)9-17/h8,17H,9H2,1-7H3.
What are the key properties of 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol?
2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol has a molecular weight of 267.37 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxy-N,3,4-trimethylanilino)-2-methylpropan-1-ol is sourced from PubChem (CID 115133353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).