(1-benzhydrylazetidin-3-yl)methanol

C17H19NO — CID 2758715

IUPAC(1-benzhydrylazetidin-3-yl)methanol
SMILESOCC1CN(C(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C17H19NO/c19-13-14-11-18(12-14)17(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,14,17,19H,11-13H2
InChIKeyGEFUGGQLCNKIQP-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.70
Rot. Bonds4

About (1-benzhydrylazetidin-3-yl)methanol

(1-benzhydrylazetidin-3-yl)methanol (PubChem CID 2758715) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is (1-benzhydrylazetidin-3-yl)methanol.

Molecular Properties

Compound Name(1-benzhydrylazetidin-3-yl)methanol
PubChem CID2758715
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name(1-benzhydrylazetidin-3-yl)methanol
SMILESOCC1CN(C(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C17H19NO/c19-13-14-11-18(12-14)17(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,14,17,19H,11-13H2
InChIKeyGEFUGGQLCNKIQP-UHFFFAOYSA-N
XLogP2.70
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-benzhydrylazetidin-3-yl)methanol?
The IUPAC name of (1-benzhydrylazetidin-3-yl)methanol (CID 2758715) is (1-benzhydrylazetidin-3-yl)methanol.
What is the SMILES notation for (1-benzhydrylazetidin-3-yl)methanol?
The canonical SMILES for (1-benzhydrylazetidin-3-yl)methanol is OCC1CN(C(c2ccccc2)c2ccccc2)C1.
What is the InChIKey of (1-benzhydrylazetidin-3-yl)methanol?
The InChIKey is GEFUGGQLCNKIQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c19-13-14-11-18(12-14)17(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,14,17,19H,11-13H2.
What are the key properties of (1-benzhydrylazetidin-3-yl)methanol?
(1-benzhydrylazetidin-3-yl)methanol has a molecular weight of 253.35 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzhydrylazetidin-3-yl)methanol is sourced from PubChem (CID 2758715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).