N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine

C18H19N3 — CID 62566802

IUPACN-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine
SMILESCNCC(c1ccccc1)n1ccnc1-c1ccccc1
InChIInChI=1S/C18H19N3/c1-19-14-17(15-8-4-2-5-9-15)21-13-12-20-18(21)16-10-6-3-7-11-16/h2-13,17,19H,14H2,1H3
InChIKeyYCSGOGHMIJPHKD-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.36
Rot. Bonds5

About N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine

N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine (PubChem CID 62566802) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine
PubChem CID62566802
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC NameN-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine
SMILESCNCC(c1ccccc1)n1ccnc1-c1ccccc1
InChIInChI=1S/C18H19N3/c1-19-14-17(15-8-4-2-5-9-15)21-13-12-20-18(21)16-10-6-3-7-11-16/h2-13,17,19H,14H2,1H3
InChIKeyYCSGOGHMIJPHKD-UHFFFAOYSA-N
XLogP3.36
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine?
The IUPAC name of N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine (CID 62566802) is N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine.
What is the SMILES notation for N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine?
The canonical SMILES for N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine is CNCC(c1ccccc1)n1ccnc1-c1ccccc1.
What is the InChIKey of N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine?
The InChIKey is YCSGOGHMIJPHKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-19-14-17(15-8-4-2-5-9-15)21-13-12-20-18(21)16-10-6-3-7-11-16/h2-13,17,19H,14H2,1H3.
What are the key properties of N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine?
N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine has a molecular weight of 277.37 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine is sourced from PubChem (CID 62566802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).