N-benzyl-N-methyl-1-phenylethanamine

C16H19N — CID 14938015

IUPACN-benzyl-N-methyl-1-phenylethanamine
SMILESCC(c1ccccc1)N(C)Cc1ccccc1
InChIInChI=1S/C16H19N/c1-14(16-11-7-4-8-12-16)17(2)13-15-9-5-3-6-10-15/h3-12,14H,13H2,1-2H3
InChIKeyWKZKTYMPZABIEF-UHFFFAOYSA-N
MW225.34 g/mol
LogP3.88
Rot. Bonds4

About N-benzyl-N-methyl-1-phenylethanamine

N-benzyl-N-methyl-1-phenylethanamine (PubChem CID 14938015) has the molecular formula C16H19N and a molecular weight of 225.34 g/mol. Its IUPAC name is N-benzyl-N-methyl-1-phenylethanamine.

Molecular Properties

Compound NameN-benzyl-N-methyl-1-phenylethanamine
PubChem CID14938015
Molecular FormulaC16H19N
Molecular Weight225.34 g/mol
Exact Mass225.15
IUPAC NameN-benzyl-N-methyl-1-phenylethanamine
SMILESCC(c1ccccc1)N(C)Cc1ccccc1
InChIInChI=1S/C16H19N/c1-14(16-11-7-4-8-12-16)17(2)13-15-9-5-3-6-10-15/h3-12,14H,13H2,1-2H3
InChIKeyWKZKTYMPZABIEF-UHFFFAOYSA-N
XLogP3.88
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-1-phenylethanamine?
The IUPAC name of N-benzyl-N-methyl-1-phenylethanamine (CID 14938015) is N-benzyl-N-methyl-1-phenylethanamine.
What is the SMILES notation for N-benzyl-N-methyl-1-phenylethanamine?
The canonical SMILES for N-benzyl-N-methyl-1-phenylethanamine is CC(c1ccccc1)N(C)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-methyl-1-phenylethanamine?
The InChIKey is WKZKTYMPZABIEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-14(16-11-7-4-8-12-16)17(2)13-15-9-5-3-6-10-15/h3-12,14H,13H2,1-2H3.
What are the key properties of N-benzyl-N-methyl-1-phenylethanamine?
N-benzyl-N-methyl-1-phenylethanamine has a molecular weight of 225.34 g/mol, XLogP of 3.88, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-1-phenylethanamine is sourced from PubChem (CID 14938015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).