6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine

C15H27N3 — CID 79243531

IUPAC6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CN(C)C(CC)CC)n1
InChIInChI=1S/C15H27N3/c1-5-11-16-15-10-8-9-13(17-15)12-18(4)14(6-2)7-3/h8-10,14H,5-7,11-12H2,1-4H3,(H,16,17)
InChIKeyLNBPSGXUEZVBIG-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.52
Rot. Bonds8

About 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine

6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine (PubChem CID 79243531) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine
PubChem CID79243531
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CN(C)C(CC)CC)n1
InChIInChI=1S/C15H27N3/c1-5-11-16-15-10-8-9-13(17-15)12-18(4)14(6-2)7-3/h8-10,14H,5-7,11-12H2,1-4H3,(H,16,17)
InChIKeyLNBPSGXUEZVBIG-UHFFFAOYSA-N
XLogP3.52
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[methyl(1-methylsulfanylbutan-2-yl)amino]methyl]-N-propylpyridin-2-amine
CID 112664312
N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine
CID 79243618
6-[[methyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 79243172
6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]-N-propylpyridin-2-amine
CID 79243725
6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylpyridin-2-amine
CID 79243620
N-[(6-chloro-2-pyridinyl)methyl]-N-methylpentan-3-amine
CID 79240734
6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 79481796
N-[[6-(ethylaminomethyl)-2-pyridinyl]methyl]-N-methylpentan-3-amine
CID 106905876
6-N-pentan-3-yl-2-N-propylpyridine-2,6-diamine
CID 80770551
3-[methyl-[[6-(propylamino)-2-pyridinyl]methyl]amino]propanenitrile
CID 79243775
6-methyl-2-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyrimidin-4-amine
CID 80657535
2-[(2-amino-2-oxoethyl)-[[6-(propylamino)-2-pyridinyl]methyl]amino]acetamide
CID 79230668

Frequently Asked Questions

What is the IUPAC name of 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine?
The IUPAC name of 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine (CID 79243531) is 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine is CCCNc1cccc(CN(C)C(CC)CC)n1.
What is the InChIKey of 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine?
The InChIKey is LNBPSGXUEZVBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-5-11-16-15-10-8-9-13(17-15)12-18(4)14(6-2)7-3/h8-10,14H,5-7,11-12H2,1-4H3,(H,16,17).
What are the key properties of 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine?
6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine has a molecular weight of 249.40 g/mol, XLogP of 3.52, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 79243531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).