6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine

C18H25N3 — CID 79233870

IUPAC6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CN(CC)Cc2ccccc2)n1
InChIInChI=1S/C18H25N3/c1-3-13-19-18-12-8-11-17(20-18)15-21(4-2)14-16-9-6-5-7-10-16/h5-12H,3-4,13-15H2,1-2H3,(H,19,20)
InChIKeyKTWUUVDIQNMUKN-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.93
Rot. Bonds8

About 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine

6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine (PubChem CID 79233870) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine
PubChem CID79233870
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CN(CC)Cc2ccccc2)n1
InChIInChI=1S/C18H25N3/c1-3-13-19-18-12-8-11-17(20-18)15-21(4-2)14-16-9-6-5-7-10-16/h5-12H,3-4,13-15H2,1-2H3,(H,19,20)
InChIKeyKTWUUVDIQNMUKN-UHFFFAOYSA-N
XLogP3.93
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 79481796
6-N-benzyl-6-N-ethyl-2-N-propylpyridine-2,6-diamine
CID 80753536
2-[(2-amino-2-oxoethyl)-[[6-(propylamino)-2-pyridinyl]methyl]amino]acetamide
CID 79230668
6-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]-N-propylpyridin-2-amine
CID 79234138
N-benzyl-N-[(4-tert-butylphenyl)methyl]ethanamine
CID 58802076
6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine
CID 79243531
6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylpyridin-2-amine
CID 79243620
2-[2,2-difluoroethyl-[[6-(propylamino)-2-pyridinyl]methyl]amino]ethanol
CID 107486212
6-N-ethyl-6-N-phenyl-2-N-propylpyridine-2,6-diamine
CID 80755878
N-propyl-6-(pyrazol-1-ylmethyl)pyridin-2-amine
CID 79232077
5-[[ethyl(pyridin-2-ylmethyl)amino]methyl]-N-propylpyrazin-2-amine
CID 103056698
6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine
CID 79234167

Frequently Asked Questions

What is the IUPAC name of 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine?
The IUPAC name of 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine (CID 79233870) is 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine is CCCNc1cccc(CN(CC)Cc2ccccc2)n1.
What is the InChIKey of 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine?
The InChIKey is KTWUUVDIQNMUKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-3-13-19-18-12-8-11-17(20-18)15-21(4-2)14-16-9-6-5-7-10-16/h5-12H,3-4,13-15H2,1-2H3,(H,19,20).
What are the key properties of 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine?
6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine has a molecular weight of 283.42 g/mol, XLogP of 3.93, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 79233870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).