(1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol

C20H17N3O — CID 134822321

IUPAC(1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol
SMILESC[C@@H](O)n1nnc(-c2ccccc2)c1-c1cccc2ccccc12
InChIInChI=1S/C20H17N3O/c1-14(24)23-20(19(21-22-23)16-9-3-2-4-10-16)18-13-7-11-15-8-5-6-12-17(15)18/h2-14,24H,1H3/t14-/m1/s1
InChIKeyZDVDORNPMNFDGE-CQSZACIVSA-N
MW315.38 g/mol
LogP4.28
Rot. Bonds3

About (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol

(1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol (PubChem CID 134822321) has the molecular formula C20H17N3O and a molecular weight of 315.38 g/mol. Its IUPAC name is (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol.

Molecular Properties

Compound Name(1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol
PubChem CID134822321
Molecular FormulaC20H17N3O
Molecular Weight315.38 g/mol
Exact Mass315.14
IUPAC Name(1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol
SMILESC[C@@H](O)n1nnc(-c2ccccc2)c1-c1cccc2ccccc12
InChIInChI=1S/C20H17N3O/c1-14(24)23-20(19(21-22-23)16-9-3-2-4-10-16)18-13-7-11-15-8-5-6-12-17(15)18/h2-14,24H,1H3/t14-/m1/s1
InChIKeyZDVDORNPMNFDGE-CQSZACIVSA-N
XLogP4.28
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-benzyl-5-naphthalen-1-yl-4-phenyltriazole
CID 102474946
7,14-dimethyl-3-naphthalen-1-yl-6,13-diphenylquinolino[4,3-j]phenanthridine
CID 134595893
(4,5-diphenyltriazol-1-yl)methanol
CID 174976406
1-phenyl-5H-triazolo[5,1-a]isoindole
CID 101373390
1,4-bis[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123399401
1-(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123841203
2-(1-naphthalen-1-yl-4,5-diphenylimidazol-2-yl)phenol
CID 137086249
4-bromo-1-methyl-5-naphthalen-1-ylpyrazole-3-carboxylic acid
CID 116858289
2-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine
CID 168731887
iridium;5-naphthalen-1-yl-3-phenyl-2-phenylpyrazine;pentane-2,4-diol
CID 58991381
1-benzyl-5-(2-methylphenyl)-4-phenyltriazole
CID 101446629
4-naphthalen-1-yl-1-propan-2-ylpyrazole
CID 97034287

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol?
The IUPAC name of (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol (CID 134822321) is (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol.
What is the SMILES notation for (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol?
The canonical SMILES for (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol is C[C@@H](O)n1nnc(-c2ccccc2)c1-c1cccc2ccccc12.
What is the InChIKey of (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol?
The InChIKey is ZDVDORNPMNFDGE-CQSZACIVSA-N. The full InChI is InChI=1S/C20H17N3O/c1-14(24)23-20(19(21-22-23)16-9-3-2-4-10-16)18-13-7-11-15-8-5-6-12-17(15)18/h2-14,24H,1H3/t14-/m1/s1.
What are the key properties of (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol?
(1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol has a molecular weight of 315.38 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(5-naphthalen-1-yl-4-phenyltriazol-1-yl)ethanol is sourced from PubChem (CID 134822321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).