N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine

C17H23N3 — CID 62293287

IUPACN-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine
SMILESCCNCc1cc(N(C)c2cc(C)cc(C)c2)ccn1
InChIInChI=1S/C17H23N3/c1-5-18-12-15-11-16(6-7-19-15)20(4)17-9-13(2)8-14(3)10-17/h6-11,18H,5,12H2,1-4H3
InChIKeyZIUNEESRCVMENG-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.58
Rot. Bonds5

About N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine

N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine (PubChem CID 62293287) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine
PubChem CID62293287
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine
SMILESCCNCc1cc(N(C)c2cc(C)cc(C)c2)ccn1
InChIInChI=1S/C17H23N3/c1-5-18-12-15-11-16(6-7-19-15)20(4)17-9-13(2)8-14(3)10-17/h6-11,18H,5,12H2,1-4H3
InChIKeyZIUNEESRCVMENG-UHFFFAOYSA-N
XLogP3.58
TPSA28.16 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 ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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4-(4-Dimethylaminostyryl)-1-methylpyridinium
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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine?
The IUPAC name of N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine (CID 62293287) is N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine is CCNCc1cc(N(C)c2cc(C)cc(C)c2)ccn1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine?
The InChIKey is ZIUNEESRCVMENG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-5-18-12-15-11-16(6-7-19-15)20(4)17-9-13(2)8-14(3)10-17/h6-11,18H,5,12H2,1-4H3.
What are the key properties of N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine?
N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine has a molecular weight of 269.39 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine is sourced from PubChem (CID 62293287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).