2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol

C23H20OSe — CID 135009849

IUPAC2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol
SMILESCC(C)(O)c1cc(-c2cccc3ccccc23)c(-c2ccccc2)[se]1
InChIInChI=1S/C23H20OSe/c1-23(2,24)21-15-20(22(25-21)17-10-4-3-5-11-17)19-14-8-12-16-9-6-7-13-18(16)19/h3-15,24H,1-2H3
InChIKeyAOMWAXUOVCOUGJ-UHFFFAOYSA-N
MW391.37 g/mol
LogP5.46
Rot. Bonds3

About 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol

2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol (PubChem CID 135009849) has the molecular formula C23H20OSe and a molecular weight of 391.37 g/mol. Its IUPAC name is 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol
PubChem CID135009849
Molecular FormulaC23H20OSe
Molecular Weight391.37 g/mol
Exact Mass392.07
IUPAC Name2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol
SMILESCC(C)(O)c1cc(-c2cccc3ccccc23)c(-c2ccccc2)[se]1
InChIInChI=1S/C23H20OSe/c1-23(2,24)21-15-20(22(25-21)17-10-4-3-5-11-17)19-14-8-12-16-9-6-7-13-18(16)19/h3-15,24H,1-2H3
InChIKeyAOMWAXUOVCOUGJ-UHFFFAOYSA-N
XLogP5.46
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.37
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2-[4-(4-methoxyphenyl)-5-phenylselenophen-2-yl]propan-2-ol
CID 135009848
2-(4-methyl-5-naphthalen-1-yl-2-phenylphenyl)propan-2-ol
CID 118360843
2-(4-butyltellanyl-5-phenylselenophen-2-yl)propan-2-ol
CID 24874282
1,6-dinaphthalen-1-yl-3,8-diphenylpyrene
CID 59391123
1-(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123841203
1,4-bis[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123399401
trimethyl-(2-naphthalen-1-yl-4-phenylphenyl)germane
CID 167332794
2-[5-fluoranthen-3-yl-4-(2-hydroxypropan-2-yl)-2-naphthalen-1-ylphenyl]propan-2-ol
CID 58261454
1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
CID 59169251
CID 175282704
CID 175282704
bis(1-naphthalen-1-ylnaphthalene);phosphane
CID 175426418
tetrakis(1-naphthalen-1-ylnaphthalene);tetrahydrochloride
CID 173126408

Frequently Asked Questions

What is the IUPAC name of 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol?
The IUPAC name of 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol (CID 135009849) is 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol.
What is the SMILES notation for 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol?
The canonical SMILES for 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol is CC(C)(O)c1cc(-c2cccc3ccccc23)c(-c2ccccc2)[se]1.
What is the InChIKey of 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol?
The InChIKey is AOMWAXUOVCOUGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20OSe/c1-23(2,24)21-15-20(22(25-21)17-10-4-3-5-11-17)19-14-8-12-16-9-6-7-13-18(16)19/h3-15,24H,1-2H3.
What are the key properties of 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol?
2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol has a molecular weight of 391.37 g/mol, XLogP of 5.46, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-naphthalen-1-yl-5-phenylselenophen-2-yl)propan-2-ol is sourced from PubChem (CID 135009849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).