diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol

C24H25NO — CID 124604999

IUPACdiphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol
SMILESC[C@H](c1ccccc1)N1CC[C@H]1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H25NO/c1-19(20-11-5-2-6-12-20)25-18-17-23(25)24(26,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,19,23,26H,17-18H2,1H3/t19-,23+/m1/s1
InChIKeySGRXPZXZFVLCLR-XXBNENTESA-N
MW343.47 g/mol
LogP4.76
Rot. Bonds5

About diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol

diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol (PubChem CID 124604999) has the molecular formula C24H25NO and a molecular weight of 343.47 g/mol. Its IUPAC name is diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol.

Molecular Properties

Compound Namediphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol
PubChem CID124604999
Molecular FormulaC24H25NO
Molecular Weight343.47 g/mol
Exact Mass343.19
IUPAC Namediphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol
SMILESC[C@H](c1ccccc1)N1CC[C@H]1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H25NO/c1-19(20-11-5-2-6-12-20)25-18-17-23(25)24(26,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,19,23,26H,17-18H2,1H3/t19-,23+/m1/s1
InChIKeySGRXPZXZFVLCLR-XXBNENTESA-N
XLogP4.76
TPSA23.47 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 ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol?
The IUPAC name of diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol (CID 124604999) is diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol.
What is the SMILES notation for diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol?
The canonical SMILES for diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol is C[C@H](c1ccccc1)N1CC[C@H]1C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol?
The InChIKey is SGRXPZXZFVLCLR-XXBNENTESA-N. The full InChI is InChI=1S/C24H25NO/c1-19(20-11-5-2-6-12-20)25-18-17-23(25)24(26,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,19,23,26H,17-18H2,1H3/t19-,23+/m1/s1.
What are the key properties of diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol?
diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol has a molecular weight of 343.47 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol is sourced from PubChem (CID 124604999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).