5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine

C17H23N3 — CID 80633214

IUPAC5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine
SMILESCCN(c1ccccc1C)c1ncc(CCN)cc1C
InChIInChI=1S/C17H23N3/c1-4-20(16-8-6-5-7-13(16)2)17-14(3)11-15(9-10-18)12-19-17/h5-8,11-12H,4,9-10,18H2,1-3H3
InChIKeyJCQXQTQEJVLFAN-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.36
Rot. Bonds5

About 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine

5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine (PubChem CID 80633214) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine
PubChem CID80633214
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine
SMILESCCN(c1ccccc1C)c1ncc(CCN)cc1C
InChIInChI=1S/C17H23N3/c1-4-20(16-8-6-5-7-13(16)2)17-14(3)11-15(9-10-18)12-19-17/h5-8,11-12H,4,9-10,18H2,1-3H3
InChIKeyJCQXQTQEJVLFAN-UHFFFAOYSA-N
XLogP3.36
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-aminoethyl)-N-(2-methoxyphenyl)-N,3-dimethylpyridin-2-amine
CID 80634800
5-(2-aminoethyl)-N,3-dimethyl-N-phenylpyridin-2-amine
CID 80633206
4-(2-aminoethyl)-2-chloro-N-ethyl-N-(2-methylphenyl)aniline
CID 81165834
4-(aminomethyl)-N-ethyl-2-methyl-N-(2-methylphenyl)aniline
CID 60929448
5-(2-aminoethyl)-N-ethyl-N-(2-ethylbutyl)-3-methylpyridin-2-amine
CID 80634153
5-bromo-N-ethyl-N-(2-fluorophenyl)-3-methylpyridin-2-amine
CID 113367248
5-bromo-3-chloro-N-ethyl-N-(2-methylphenyl)pyridin-2-amine
CID 103583130
5-(2-aminobutyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine
CID 80630732
5-(2-aminopropyl)-N,3-dimethyl-N-(2-methylphenyl)pyridin-2-amine
CID 80634444
N'-[5-(2-aminoethyl)-3-methyl-2-pyridinyl]-N,N,N'-trimethylethane-1,2-diamine
CID 80634571
5-(2-aminoethyl)-N-ethyl-N-(2-methylphenyl)-1,3,4-oxadiazol-2-amine
CID 106966902
5-(2-aminoethyl)-N-[1-(2-fluorophenyl)ethyl]-N,3-dimethylpyridin-2-amine
CID 80636823

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine?
The IUPAC name of 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine (CID 80633214) is 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine.
What is the SMILES notation for 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine?
The canonical SMILES for 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine is CCN(c1ccccc1C)c1ncc(CCN)cc1C.
What is the InChIKey of 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine?
The InChIKey is JCQXQTQEJVLFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-4-20(16-8-6-5-7-13(16)2)17-14(3)11-15(9-10-18)12-19-17/h5-8,11-12H,4,9-10,18H2,1-3H3.
What are the key properties of 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine?
5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine has a molecular weight of 269.39 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 5-(2-aminoethyl)-N-ethyl-3-methyl-N-(2-methylphenyl)pyridin-2-amine is sourced from PubChem (CID 80633214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).