2-(1-tritylaziridin-2-yl)propan-2-ol

C24H25NO — CID 134197925

IUPAC2-(1-tritylaziridin-2-yl)propan-2-ol
SMILESCC(C)(O)C1CN1C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H25NO/c1-23(2,26)22-18-25(22)24(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17,22,26H,18H2,1-2H3
InChIKeyBHSVLNOYWJAGIQ-UHFFFAOYSA-N
MW343.47 g/mol
LogP4.43
Rot. Bonds5

About 2-(1-tritylaziridin-2-yl)propan-2-ol

2-(1-tritylaziridin-2-yl)propan-2-ol (PubChem CID 134197925) has the molecular formula C24H25NO and a molecular weight of 343.47 g/mol. Its IUPAC name is 2-(1-tritylaziridin-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(1-tritylaziridin-2-yl)propan-2-ol
PubChem CID134197925
Molecular FormulaC24H25NO
Molecular Weight343.47 g/mol
Exact Mass343.19
IUPAC Name2-(1-tritylaziridin-2-yl)propan-2-ol
SMILESCC(C)(O)C1CN1C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H25NO/c1-23(2,26)22-18-25(22)24(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17,22,26H,18H2,1-2H3
InChIKeyBHSVLNOYWJAGIQ-UHFFFAOYSA-N
XLogP4.43
TPSA23.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

2-[methoxy(diphenyl)methyl]-1-tritylaziridine
CID 5249582
bis[4-(dimethoxymethyl)phenyl]-[(2S)-1-tritylaziridin-2-yl]methanol
CID 16754944
1-(1-tritylaziridin-2-yl)propan-1-ol
CID 163775047
[(2S)-1-methylaziridin-2-yl]-diphenylmethanol
CID 101268186
2-[(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]propan-2-ol
CID 12025791
(2S,4S)-4-hydroxy-1-tritylpyrrolidine-2-carboxylic acid
CID 15927496
(2S)-1-tritylpyrrolidine-2,4-dicarboxylic acid
CID 69364853
[(1S,3S,4S)-5-trityl-2,5-diazabicyclo[2.2.1]heptan-3-yl]methanol
CID 177181754
(2S)-3-methyl-1-trityl-2,5-dihydropyrrole-2-carboxylic acid
CID 140630872
methyl (2S)-4-hydroxy-1-tritylpyrrolidine-2-carboxylate
CID 150507441
1-tritylazetidine-3-carboxylic acid
CID 53445406
methyl 1-tritylazetidine-2-carboxylate
CID 22328406

Frequently Asked Questions

What is the IUPAC name of 2-(1-tritylaziridin-2-yl)propan-2-ol?
The IUPAC name of 2-(1-tritylaziridin-2-yl)propan-2-ol (CID 134197925) is 2-(1-tritylaziridin-2-yl)propan-2-ol.
What is the SMILES notation for 2-(1-tritylaziridin-2-yl)propan-2-ol?
The canonical SMILES for 2-(1-tritylaziridin-2-yl)propan-2-ol is CC(C)(O)C1CN1C(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(1-tritylaziridin-2-yl)propan-2-ol?
The InChIKey is BHSVLNOYWJAGIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO/c1-23(2,26)22-18-25(22)24(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17,22,26H,18H2,1-2H3.
What are the key properties of 2-(1-tritylaziridin-2-yl)propan-2-ol?
2-(1-tritylaziridin-2-yl)propan-2-ol has a molecular weight of 343.47 g/mol, XLogP of 4.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-tritylaziridin-2-yl)propan-2-ol is sourced from PubChem (CID 134197925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).