N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide

C22H27NO3 — CID 10760540

IUPACN-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide
SMILESCC(C)(C)NC(=O)C1CC(c2ccccc2)(c2ccccc2)OC1(C)O
InChIInChI=1S/C22H27NO3/c1-20(2,3)23-19(24)18-15-22(26-21(18,4)25,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-14,18,25H,15H2,1-4H3,(H,23,24)
InChIKeyBIRFQYMGIKIQQN-UHFFFAOYSA-N
MW353.46 g/mol
LogP3.59
Rot. Bonds3

About N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide

N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide (PubChem CID 10760540) has the molecular formula C22H27NO3 and a molecular weight of 353.46 g/mol. Its IUPAC name is N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide
PubChem CID10760540
Molecular FormulaC22H27NO3
Molecular Weight353.46 g/mol
Exact Mass353.20
IUPAC NameN-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide
SMILESCC(C)(C)NC(=O)C1CC(c2ccccc2)(c2ccccc2)OC1(C)O
InChIInChI=1S/C22H27NO3/c1-20(2,3)23-19(24)18-15-22(26-21(18,4)25,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-14,18,25H,15H2,1-4H3,(H,23,24)
InChIKeyBIRFQYMGIKIQQN-UHFFFAOYSA-N
XLogP3.59
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.46
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1R,2R,3S)-N-tert-butyl-2-methyl-2-phenyl-3-phenylmethoxycyclopropane-1-carboxamide
CID 102497858
N-tert-butyl-5,5-bis(4-fluorophenyl)-2-hydroxy-2-methyloxolane-3-carboxamide
CID 10762918
2,2-Diphenyltetrahydrofuran-5-acetamide, N-t-butyl-
CID 593827
ethane;N-methyl-5-oxo-2,2-diphenyloxolane-3-carboxamide
CID 177952864
2-hydroxy-2-methyl-N-[3-(3-oxobutanoylamino)propyl]-5,5-diphenyloxolane-3-carboxamide
CID 10622882
N-tert-butyl-2-hydroxy-5,5-bis(4-methoxyphenyl)-2-methyloxolane-3-carboxamide
CID 10645415
N-tert-butyl-5,5-bis(4-chlorophenyl)-2-hydroxy-2-methyloxolane-3-carboxamide
CID 10645884
N-tert-butyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide
CID 10664528
N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide
CID 10691625
N-tert-butyl-5-methyl-2,2-bis(4-methylphenyl)-3H-furan-4-carboxamide
CID 10713768
N-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide
CID 10736798
2-hydroxy-2-methyl-N-[6-(3-oxobutanoylamino)hexyl]-5,5-diphenyloxolane-3-carboxamide
CID 10790892

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide?
The IUPAC name of N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide (CID 10760540) is N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide.
What is the SMILES notation for N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide?
The canonical SMILES for N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide is CC(C)(C)NC(=O)C1CC(c2ccccc2)(c2ccccc2)OC1(C)O.
What is the InChIKey of N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide?
The InChIKey is BIRFQYMGIKIQQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27NO3/c1-20(2,3)23-19(24)18-15-22(26-21(18,4)25,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5-14,18,25H,15H2,1-4H3,(H,23,24).
What are the key properties of N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide?
N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide has a molecular weight of 353.46 g/mol, XLogP of 3.59, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide is sourced from PubChem (CID 10760540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).