3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine

C17H23N3 — CID 62003686

IUPAC3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine
SMILESCc1ccc(N(C)c2nc(C)cc(C)c2CN)c(C)c1
InChIInChI=1S/C17H23N3/c1-11-6-7-16(13(3)8-11)20(5)17-15(10-18)12(2)9-14(4)19-17/h6-9H,10,18H2,1-5H3
InChIKeyXXVGAMBWJUCARQ-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.54
Rot. Bonds3

About 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine

3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine (PubChem CID 62003686) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine
PubChem CID62003686
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine
SMILESCc1ccc(N(C)c2nc(C)cc(C)c2CN)c(C)c1
InChIInChI=1S/C17H23N3/c1-11-6-7-16(13(3)8-11)20(5)17-15(10-18)12(2)9-14(4)19-17/h6-9H,10,18H2,1-5H3
InChIKeyXXVGAMBWJUCARQ-UHFFFAOYSA-N
XLogP3.54
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine (CID 62003686) is 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine is Cc1ccc(N(C)c2nc(C)cc(C)c2CN)c(C)c1.
What is the InChIKey of 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine?
The InChIKey is XXVGAMBWJUCARQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-11-6-7-16(13(3)8-11)20(5)17-15(10-18)12(2)9-14(4)19-17/h6-9H,10,18H2,1-5H3.
What are the key properties of 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine?
3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine has a molecular weight of 269.39 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-(2,4-dimethylphenyl)-N,4,6-trimethylpyridin-2-amine is sourced from PubChem (CID 62003686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).