(2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine

C19H23NO — CID 134941319

IUPAC(2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine
SMILESCOC(c1ccccc1)(c1ccccc1)[C@@H]1CC(C)CN1
InChIInChI=1S/C19H23NO/c1-15-13-18(20-14-15)19(21-2,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15,18,20H,13-14H2,1-2H3/t15?,18-/m0/s1
InChIKeyMUEYYCKCPVKWTJ-PKHIMPSTSA-N
MW281.40 g/mol
LogP3.57
Rot. Bonds4

About (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine

(2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine (PubChem CID 134941319) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine.

Molecular Properties

Compound Name(2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine
PubChem CID134941319
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name(2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine
SMILESCOC(c1ccccc1)(c1ccccc1)[C@@H]1CC(C)CN1
InChIInChI=1S/C19H23NO/c1-15-13-18(20-14-15)19(21-2,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15,18,20H,13-14H2,1-2H3/t15?,18-/m0/s1
InChIKeyMUEYYCKCPVKWTJ-PKHIMPSTSA-N
XLogP3.57
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4R)-2-[fluoro(diphenyl)methyl]-4-methoxypyrrolidine
CID 11471670
(2R,4R)-4-methyl-2-phenylpyrrolidine
CID 101063094
(2S)-2-[(1S)-1-methoxy-1-phenylethyl]azetidine
CID 170368701
ethane;4-methyl-2-phenylpyrrolidine
CID 142973679
2-[methoxy(diphenyl)methyl]-1-tritylaziridine
CID 5249582
2-(1,1-diphenylbutyl)aziridine
CID 88534913
[diphenyl-[(2S)-pyrrolidin-2-yl]methyl] dimethyl borate
CID 71068491
(4R,5R)-2-[(1S,2S)-2-iodocyclopropyl]-4,5-bis[methoxy(diphenyl)methyl]-1,3,2-dioxaborolane
CID 101481542
[(2S,4R)-4-methylpyrrolidin-2-yl]-phenylmethanol
CID 101194740
cyclopropyl-methoxy-phenylmethanol
CID 154503172
CID 163685610
CID 163685610
[(2S,4R)-4-[tert-butyl(dimethyl)silyl]oxypyrrolidin-2-yl]-diphenylmethanol
CID 102172046

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine?
The IUPAC name of (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine (CID 134941319) is (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine.
What is the SMILES notation for (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine?
The canonical SMILES for (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine is COC(c1ccccc1)(c1ccccc1)[C@@H]1CC(C)CN1.
What is the InChIKey of (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine?
The InChIKey is MUEYYCKCPVKWTJ-PKHIMPSTSA-N. The full InChI is InChI=1S/C19H23NO/c1-15-13-18(20-14-15)19(21-2,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15,18,20H,13-14H2,1-2H3/t15?,18-/m0/s1.
What are the key properties of (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine?
(2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine has a molecular weight of 281.40 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[methoxy(diphenyl)methyl]-4-methylpyrrolidine is sourced from PubChem (CID 134941319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).