N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine

C16H20N2 — CID 60819742

IUPACN-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine
SMILESCCNC(Cc1ccccn1)c1ccccc1C
InChIInChI=1S/C16H20N2/c1-3-17-16(12-14-9-6-7-11-18-14)15-10-5-4-8-13(15)2/h4-11,16-17H,3,12H2,1-2H3
InChIKeyFQCZQLDHMYBDHB-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.28
Rot. Bonds5

About N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine

N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine (PubChem CID 60819742) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine.

Molecular Properties

Compound NameN-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine
PubChem CID60819742
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine
SMILESCCNC(Cc1ccccn1)c1ccccc1C
InChIInChI=1S/C16H20N2/c1-3-17-16(12-14-9-6-7-11-18-14)15-10-5-4-8-13(15)2/h4-11,16-17H,3,12H2,1-2H3
InChIKeyFQCZQLDHMYBDHB-UHFFFAOYSA-N
XLogP3.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine?
The IUPAC name of N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine (CID 60819742) is N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine.
What is the SMILES notation for N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine?
The canonical SMILES for N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine is CCNC(Cc1ccccn1)c1ccccc1C.
What is the InChIKey of N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine?
The InChIKey is FQCZQLDHMYBDHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-3-17-16(12-14-9-6-7-11-18-14)15-10-5-4-8-13(15)2/h4-11,16-17H,3,12H2,1-2H3.
What are the key properties of N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine?
N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine has a molecular weight of 240.35 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-methylphenyl)-2-pyridin-2-ylethanamine is sourced from PubChem (CID 60819742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).