N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide

C25H25NO3 — CID 10691625

IUPACN-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide
SMILESCC1(O)OC(c2ccccc2)(c2ccccc2)CC1C(=O)NCc1ccccc1
InChIInChI=1S/C25H25NO3/c1-24(28)22(23(27)26-18-19-11-5-2-6-12-19)17-25(29-24,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,22,28H,17-18H2,1H3,(H,26,27)
InChIKeyMEMMGELUCOHKEP-UHFFFAOYSA-N
MW387.48 g/mol
LogP3.99
Rot. Bonds5

About N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide

N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide (PubChem CID 10691625) has the molecular formula C25H25NO3 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide
PubChem CID10691625
Molecular FormulaC25H25NO3
Molecular Weight387.48 g/mol
Exact Mass387.18
IUPAC NameN-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide
SMILESCC1(O)OC(c2ccccc2)(c2ccccc2)CC1C(=O)NCc1ccccc1
InChIInChI=1S/C25H25NO3/c1-24(28)22(23(27)26-18-19-11-5-2-6-12-19)17-25(29-24,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,22,28H,17-18H2,1H3,(H,26,27)
InChIKeyMEMMGELUCOHKEP-UHFFFAOYSA-N
XLogP3.99
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,3S)-N-benzyl-2-(3-fluorophenyl)-3-phenylmethoxypent-4-enamide
CID 164579285
N-benzyl-3-hydroxy-3,3-diphenylpropanamide
CID 10980465
N-tert-butyl-5,5-bis(4-fluorophenyl)-2-hydroxy-2-methyloxolane-3-carboxamide
CID 10762918
N-[2-(1-benzylpiperidin-4-yl)ethyl]-5,5-diphenyloxolane-3-carboxamide
CID 59243658
N-benzyl-3-hydroxy-3-phenylbutanamide
CID 110024222
Benzyl 3-(benzylamino)-3-oxo-2-phenylpropanoate
CID 141592017
(2R,3S)-N-benzyl-2-(4-methylphenyl)-3-phenylmethoxypent-4-enamide
CID 164579265
(2R,3R)-N-benzyl-2-(4-methylphenyl)-3-phenylmethoxypent-4-enamide
CID 164579283
(2R,3S)-N-benzyl-2-phenyl-3-phenylmethoxypent-4-enamide
CID 164579287
N-benzyl-4-hydroxy-4,4-diphenylbutanamide
CID 10382939
2-hydroxy-2-methyl-N-[3-(3-oxobutanoylamino)propyl]-5,5-diphenyloxolane-3-carboxamide
CID 10622882
N-benzyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide
CID 10642847

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide?
The IUPAC name of N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide (CID 10691625) is N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide.
What is the SMILES notation for N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide?
The canonical SMILES for N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide is CC1(O)OC(c2ccccc2)(c2ccccc2)CC1C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide?
The InChIKey is MEMMGELUCOHKEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25NO3/c1-24(28)22(23(27)26-18-19-11-5-2-6-12-19)17-25(29-24,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,22,28H,17-18H2,1H3,(H,26,27).
What are the key properties of N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide?
N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide has a molecular weight of 387.48 g/mol, XLogP of 3.99, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-hydroxy-2-methyl-5,5-diphenyloxolane-3-carboxamide is sourced from PubChem (CID 10691625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).