2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol

C15H25NO — CID 61048191

IUPAC2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol
SMILESCC(C)NC(C)(CO)c1ccc(C(C)C)cc1
InChIInChI=1S/C15H25NO/c1-11(2)13-6-8-14(9-7-13)15(5,10-17)16-12(3)4/h6-9,11-12,16-17H,10H2,1-5H3
InChIKeyIQEAKUNSZMYBNI-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.02
Rot. Bonds5

About 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol

2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol (PubChem CID 61048191) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol
PubChem CID61048191
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol
SMILESCC(C)NC(C)(CO)c1ccc(C(C)C)cc1
InChIInChI=1S/C15H25NO/c1-11(2)13-6-8-14(9-7-13)15(5,10-17)16-12(3)4/h6-9,11-12,16-17H,10H2,1-5H3
InChIKeyIQEAKUNSZMYBNI-UHFFFAOYSA-N
XLogP3.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclohexylamino)-2-(4-propan-2-ylphenyl)propan-1-ol
CID 61047114
2-(2-methoxyethylamino)-2-(4-propan-2-ylphenyl)propan-1-ol
CID 62543812
2-(butan-2-ylamino)-2-(4-chlorophenyl)propan-1-ol
CID 61049008
2-(3-methylphenyl)-2-(propan-2-ylamino)propan-1-ol
CID 61308364
2-(4-propan-2-ylphenyl)propan-2-ol
CID 18935
ethyl 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propanoate
CID 60788346
2-methyl-2-(propan-2-ylamino)-5-(4-propan-2-ylphenoxy)pentan-1-ol
CID 64805149
2-(butan-2-ylamino)-2-(4-methylsulfanylphenyl)propan-1-ol
CID 61048813
2-(butan-2-ylamino)-2-[4-(dimethylamino)phenyl]propan-1-ol
CID 61049003
ethane;2-methyl-2-(4-propan-2-ylphenyl)propanenitrile
CID 143997025
3-methyl-2-(4-propan-2-ylphenyl)butan-2-ol
CID 62800591
1-tert-butyl-4-[chloro-(4-propan-2-ylphenyl)methyl]benzene
CID 63431525

Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol?
The IUPAC name of 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol (CID 61048191) is 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol.
What is the SMILES notation for 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol?
The canonical SMILES for 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol is CC(C)NC(C)(CO)c1ccc(C(C)C)cc1.
What is the InChIKey of 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol?
The InChIKey is IQEAKUNSZMYBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-11(2)13-6-8-14(9-7-13)15(5,10-17)16-12(3)4/h6-9,11-12,16-17H,10H2,1-5H3.
What are the key properties of 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol?
2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol has a molecular weight of 235.37 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propan-2-ylamino)-2-(4-propan-2-ylphenyl)propan-1-ol is sourced from PubChem (CID 61048191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).