N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine

C18H25N3 — CID 115939684

IUPACN-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine
SMILESCCC(NC)c1ccc(N(C)CCc2ccccc2)cn1
InChIInChI=1S/C18H25N3/c1-4-17(19-2)18-11-10-16(14-20-18)21(3)13-12-15-8-6-5-7-9-15/h5-11,14,17,19H,4,12-13H2,1-3H3
InChIKeyUOFUPYCGYQWDJG-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.43
Rot. Bonds7

About N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine

N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine (PubChem CID 115939684) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine.

Molecular Properties

Compound NameN-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine
PubChem CID115939684
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine
SMILESCCC(NC)c1ccc(N(C)CCc2ccccc2)cn1
InChIInChI=1S/C18H25N3/c1-4-17(19-2)18-11-10-16(14-20-18)21(3)13-12-15-8-6-5-7-9-15/h5-11,14,17,19H,4,12-13H2,1-3H3
InChIKeyUOFUPYCGYQWDJG-UHFFFAOYSA-N
XLogP3.43
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine?
The IUPAC name of N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine (CID 115939684) is N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine.
What is the SMILES notation for N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine?
The canonical SMILES for N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine is CCC(NC)c1ccc(N(C)CCc2ccccc2)cn1.
What is the InChIKey of N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine?
The InChIKey is UOFUPYCGYQWDJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-4-17(19-2)18-11-10-16(14-20-18)21(3)13-12-15-8-6-5-7-9-15/h5-11,14,17,19H,4,12-13H2,1-3H3.
What are the key properties of N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine?
N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine has a molecular weight of 283.42 g/mol, XLogP of 3.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine is sourced from PubChem (CID 115939684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).