2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol

C18H23NO2 — CID 61048291

IUPAC2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol
SMILESCOc1ccccc1NC(CO)(c1ccccc1)C(C)C
InChIInChI=1S/C18H23NO2/c1-14(2)18(13-20,15-9-5-4-6-10-15)19-16-11-7-8-12-17(16)21-3/h4-12,14,19-20H,13H2,1-3H3
InChIKeyUZHRILAKFXFWSB-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.65
Rot. Bonds6

About 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol

2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol (PubChem CID 61048291) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol.

Molecular Properties

Compound Name2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol
PubChem CID61048291
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol
SMILESCOc1ccccc1NC(CO)(c1ccccc1)C(C)C
InChIInChI=1S/C18H23NO2/c1-14(2)18(13-20,15-9-5-4-6-10-15)19-16-11-7-8-12-17(16)21-3/h4-12,14,19-20H,13H2,1-3H3
InChIKeyUZHRILAKFXFWSB-UHFFFAOYSA-N
XLogP3.65
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyanilino)-2,3-dimethylbutan-1-ol
CID 62488457
2-ethyl-2-(2-methoxyanilino)butan-1-ol
CID 61049290
2-(2-methoxyanilino)-4-methyl-2-(2-methylpropyl)pentanoic acid
CID 114868127
1-(2-methoxyanilino)-2-phenylpropan-2-ol
CID 62374822
4-methoxy-2-(2-methoxyanilino)-2,4-dimethylpentan-1-ol
CID 61050474
5-[1-hydroxy-2-(2-methoxyanilino)propan-2-yl]benzene-1,3-diol
CID 107707749
2-(3-bromoanilino)-3-methyl-2-phenylbutan-1-ol
CID 61048068
2-methoxy-N-(1,1,1-trifluoro-2-phenylpropan-2-yl)aniline
CID 74337625
2-methoxy-N-(2-methyl-2-phenylpropyl)aniline
CID 82538820
2-cyclopropyl-2-(2-methoxyanilino)butan-1-ol
CID 64919153
2-(2-methoxyanilino)-2,4-dimethylpentanamide
CID 54892038
2-(2-methoxyanilino)-2-methylnonan-1-ol
CID 61050086

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol?
The IUPAC name of 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol (CID 61048291) is 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol.
What is the SMILES notation for 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol?
The canonical SMILES for 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol is COc1ccccc1NC(CO)(c1ccccc1)C(C)C.
What is the InChIKey of 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol?
The InChIKey is UZHRILAKFXFWSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-14(2)18(13-20,15-9-5-4-6-10-15)19-16-11-7-8-12-17(16)21-3/h4-12,14,19-20H,13H2,1-3H3.
What are the key properties of 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol?
2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol has a molecular weight of 285.39 g/mol, XLogP of 3.65, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyanilino)-3-methyl-2-phenylbutan-1-ol is sourced from PubChem (CID 61048291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).