2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol

C26H27NO — CID 59341606

IUPAC2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol
SMILESCC(C)(N)c1ccc2ccccc2c1-c1c(C(C)(C)O)ccc2ccccc12
InChIInChI=1S/C26H27NO/c1-25(2,27)21-15-13-17-9-5-7-11-19(17)23(21)24-20-12-8-6-10-18(20)14-16-22(24)26(3,4)28/h5-16,28H,27H2,1-4H3
InChIKeyMWXUEWMXIOFQRA-UHFFFAOYSA-N
MW369.51 g/mol
LogP6.08
Rot. Bonds3

About 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol

2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol (PubChem CID 59341606) has the molecular formula C26H27NO and a molecular weight of 369.51 g/mol. Its IUPAC name is 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol.

Molecular Properties

Compound Name2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol
PubChem CID59341606
Molecular FormulaC26H27NO
Molecular Weight369.51 g/mol
Exact Mass369.21
IUPAC Name2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol
SMILESCC(C)(N)c1ccc2ccccc2c1-c1c(C(C)(C)O)ccc2ccccc12
InChIInChI=1S/C26H27NO/c1-25(2,27)21-15-13-17-9-5-7-11-19(17)23(21)24-20-12-8-6-10-18(20)14-16-22(24)26(3,4)28/h5-16,28H,27H2,1-4H3
InChIKeyMWXUEWMXIOFQRA-UHFFFAOYSA-N
XLogP6.08
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.51
LogP ≤ 56.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(9-Phenanthryl)-1-cyclohexanol
CID 4130326
4-Methyl-alpha,alpha-diphenyl-1-naphthalenemethanol
CID 2817969
Naphthalen-2-yl(diphenyl)methanol
CID 275726
1-Naphthalen-2-yl-1-phenylethanol
CID 2793942
(3-Aminonaphthalen-2-yl)-diphenylmethanol
CID 10041997
2-(9-Phenanthryl)-2-propanol
CID 10681303
2-Pyren-1-ylpropan-2-ol
CID 10848930
(1S)-1-naphthalen-2-yl-1-phenylethanol
CID 23649722
2-Amino-2-hydroxy-1,1-binaphthyl
CID 129735637
(s)-2-Amino-2-hydroxy-1,1-binaphthalene
CID 129735717
(1S)-1-(4-methylphenyl)-1-naphthalen-2-ylethanol
CID 130231644
Benz[a]anthracen-12-ol, 7,12-dihydro-12-methyl-7-methylene-
CID 153832

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol?
The IUPAC name of 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol (CID 59341606) is 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol.
What is the SMILES notation for 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol?
The canonical SMILES for 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol is CC(C)(N)c1ccc2ccccc2c1-c1c(C(C)(C)O)ccc2ccccc12.
What is the InChIKey of 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol?
The InChIKey is MWXUEWMXIOFQRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27NO/c1-25(2,27)21-15-13-17-9-5-7-11-19(17)23(21)24-20-12-8-6-10-18(20)14-16-22(24)26(3,4)28/h5-16,28H,27H2,1-4H3.
What are the key properties of 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol?
2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol has a molecular weight of 369.51 g/mol, XLogP of 6.08, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-aminopropan-2-yl)naphthalen-1-yl]naphthalen-2-yl]propan-2-ol is sourced from PubChem (CID 59341606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).