2-benzhydryloxy-N,N-dimethylethanamine

C17H21NO — CID 3100

IUPAC2-benzhydryloxy-N,N-dimethylethanamine
SMILESCN(C)CCOC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3
InChIKeyZZVUWRFHKOJYTH-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.35
Rot. Bonds6

About 2-benzhydryloxy-N,N-dimethylethanamine

2-benzhydryloxy-N,N-dimethylethanamine (PubChem CID 3100) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-benzhydryloxy-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-benzhydryloxy-N,N-dimethylethanamine
PubChem CID3100
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name2-benzhydryloxy-N,N-dimethylethanamine
SMILESCN(C)CCOC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3
InChIKeyZZVUWRFHKOJYTH-UHFFFAOYSA-N
XLogP3.35
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-benzhydryloxy-N,N-dimethylethanamine?
The IUPAC name of 2-benzhydryloxy-N,N-dimethylethanamine (CID 3100) is 2-benzhydryloxy-N,N-dimethylethanamine.
What is the SMILES notation for 2-benzhydryloxy-N,N-dimethylethanamine?
The canonical SMILES for 2-benzhydryloxy-N,N-dimethylethanamine is CN(C)CCOC(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-benzhydryloxy-N,N-dimethylethanamine?
The InChIKey is ZZVUWRFHKOJYTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3.
What are the key properties of 2-benzhydryloxy-N,N-dimethylethanamine?
2-benzhydryloxy-N,N-dimethylethanamine has a molecular weight of 255.36 g/mol, XLogP of 3.35, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzhydryloxy-N,N-dimethylethanamine is sourced from PubChem (CID 3100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).