2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol

C18H23NO2 — CID 61046598

IUPAC2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol
SMILESCC(C)Oc1ccc(C(C)(CO)Nc2ccccc2)cc1
InChIInChI=1S/C18H23NO2/c1-14(2)21-17-11-9-15(10-12-17)18(3,13-20)19-16-7-5-4-6-8-16/h4-12,14,19-20H,13H2,1-3H3
InChIKeyPPHQGLFWAVZLQN-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.79
Rot. Bonds6

About 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol

2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol (PubChem CID 61046598) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol.

Molecular Properties

Compound Name2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol
PubChem CID61046598
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol
SMILESCC(C)Oc1ccc(C(C)(CO)Nc2ccccc2)cc1
InChIInChI=1S/C18H23NO2/c1-14(2)21-17-11-9-15(10-12-17)18(3,13-20)19-16-7-5-4-6-8-16/h4-12,14,19-20H,13H2,1-3H3
InChIKeyPPHQGLFWAVZLQN-UHFFFAOYSA-N
XLogP3.79
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 ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-1-(4-propan-2-yloxyphenyl)ethanol
CID 62795392
2-(4-chloroanilino)-2-(4-methoxyphenyl)propan-1-ol
CID 61048116
2-anilino-2-(4-propan-2-yloxyphenyl)ethanol
CID 61047340
3-(ethylamino)-3-(4-propan-2-yloxyphenyl)butanoic acid
CID 65233979
N-benzyl-4-propan-2-yloxyaniline
CID 28969524
2-(3-amino-5-methoxyanilino)-2-phenylpropan-1-ol
CID 105057714
N-[(2R)-2-hydroxy-2-phenylpropyl]-4-propan-2-yloxybenzamide
CID 95367999
N-(2-phenylethyl)-4-propan-2-yloxyaniline
CID 28969676
2-anilino-2-(2,6-difluorophenyl)propan-1-ol
CID 61046430
2-(2-chloroanilino)-2-(4-methoxyphenyl)propan-1-ol
CID 61050529
N'-phenyl-N-[(4-propan-2-yloxyphenyl)methyl]ethane-1,2-diamine
CID 54806264
1-(2-methyl-2-phenylpropyl)-3-(4-propan-2-yloxyphenyl)urea
CID 113213293

Frequently Asked Questions

What is the IUPAC name of 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol?
The IUPAC name of 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol (CID 61046598) is 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol.
What is the SMILES notation for 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol?
The canonical SMILES for 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol is CC(C)Oc1ccc(C(C)(CO)Nc2ccccc2)cc1.
What is the InChIKey of 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol?
The InChIKey is PPHQGLFWAVZLQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-14(2)21-17-11-9-15(10-12-17)18(3,13-20)19-16-7-5-4-6-8-16/h4-12,14,19-20H,13H2,1-3H3.
What are the key properties of 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol?
2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol has a molecular weight of 285.39 g/mol, XLogP of 3.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol is sourced from PubChem (CID 61046598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).