N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine

C18H25N3 — CID 115939182

IUPACN-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine
SMILESCCC(NC)c1ccc(N(CC)c2ccccc2C)cn1
InChIInChI=1S/C18H25N3/c1-5-16(19-4)17-12-11-15(13-20-17)21(6-2)18-10-8-7-9-14(18)3/h7-13,16,19H,5-6H2,1-4H3
InChIKeyDBALAERIMALYKH-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.22
Rot. Bonds6

About N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine

N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine (PubChem CID 115939182) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine.

Molecular Properties

Compound NameN-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine
PubChem CID115939182
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine
SMILESCCC(NC)c1ccc(N(CC)c2ccccc2C)cn1
InChIInChI=1S/C18H25N3/c1-5-16(19-4)17-12-11-15(13-20-17)21(6-2)18-10-8-7-9-14(18)3/h7-13,16,19H,5-6H2,1-4H3
InChIKeyDBALAERIMALYKH-UHFFFAOYSA-N
XLogP4.22
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine?
The IUPAC name of N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine (CID 115939182) is N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine.
What is the SMILES notation for N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine?
The canonical SMILES for N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine is CCC(NC)c1ccc(N(CC)c2ccccc2C)cn1.
What is the InChIKey of N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine?
The InChIKey is DBALAERIMALYKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-5-16(19-4)17-12-11-15(13-20-17)21(6-2)18-10-8-7-9-14(18)3/h7-13,16,19H,5-6H2,1-4H3.
What are the key properties of N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine?
N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine has a molecular weight of 283.42 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine is sourced from PubChem (CID 115939182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).