2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol

C18H23NO2 — CID 61047503

IUPAC2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol
SMILESCOc1ccc(CCC(C)(CO)Nc2ccccc2)cc1
InChIInChI=1S/C18H23NO2/c1-18(14-20,19-16-6-4-3-5-7-16)13-12-15-8-10-17(21-2)11-9-15/h3-11,19-20H,12-14H2,1-2H3
InChIKeyYCEUHTCXNZAVFH-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.49
Rot. Bonds7

About 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol

2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol (PubChem CID 61047503) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol
PubChem CID61047503
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol
SMILESCOc1ccc(CCC(C)(CO)Nc2ccccc2)cc1
InChIInChI=1S/C18H23NO2/c1-18(14-20,19-16-6-4-3-5-7-16)13-12-15-8-10-17(21-2)11-9-15/h3-11,19-20H,12-14H2,1-2H3
InChIKeyYCEUHTCXNZAVFH-UHFFFAOYSA-N
XLogP3.49
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyanilino)-2-methyl-4-phenylbutan-1-ol
CID 61045480
4-(4-methoxyphenyl)-2-methyl-2-(propylamino)butan-1-ol
CID 61056815
2-anilino-2-methylpentan-1-ol
CID 61046243
2-(4-fluoroanilino)-3-(4-methoxyphenyl)-2-methylpropan-1-ol
CID 63271193
3-(ethylamino)-5-(4-methoxyphenyl)-3-methylpentan-1-ol
CID 65235107
2-[2-(4-methoxyphenyl)ethyl]-2-(2-phenylethyl)propanedioic acid
CID 122530743
4-[3-(benzylamino)-4-hydroxy-3-methylbutyl]phenol
CID 61046174
2-anilino-3-(2-methoxyphenyl)-2-methylpropan-1-ol
CID 61047342
N-[1,2-dideuterio-3-(4-methoxyphenyl)propyl]aniline
CID 177404327
2-(3-methoxyanilino)-2-methylheptan-1-ol
CID 80558936
2-(4-methoxyanilino)-2-phenylpentan-1-ol
CID 61045133
1-methoxy-4-(4-phenylbutyl)benzene
CID 15647797

Frequently Asked Questions

What is the IUPAC name of 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol?
The IUPAC name of 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol (CID 61047503) is 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol.
What is the SMILES notation for 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol?
The canonical SMILES for 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol is COc1ccc(CCC(C)(CO)Nc2ccccc2)cc1.
What is the InChIKey of 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol?
The InChIKey is YCEUHTCXNZAVFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-18(14-20,19-16-6-4-3-5-7-16)13-12-15-8-10-17(21-2)11-9-15/h3-11,19-20H,12-14H2,1-2H3.
What are the key properties of 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol?
2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol has a molecular weight of 285.39 g/mol, XLogP of 3.49, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-4-(4-methoxyphenyl)-2-methylbutan-1-ol is sourced from PubChem (CID 61047503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).