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

C13H23N3 — CID 79243618

IUPACN-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine
SMILESCCC(CC)N(C)Cc1cccc(NC)n1
InChIInChI=1S/C13H23N3/c1-5-12(6-2)16(4)10-11-8-7-9-13(14-3)15-11/h7-9,12H,5-6,10H2,1-4H3,(H,14,15)
InChIKeyNNAJCSFKJUBNGS-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.74
Rot. Bonds6

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

N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine (PubChem CID 79243618) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine
PubChem CID79243618
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine
SMILESCCC(CC)N(C)Cc1cccc(NC)n1
InChIInChI=1S/C13H23N3/c1-5-12(6-2)16(4)10-11-8-7-9-13(14-3)15-11/h7-9,12H,5-6,10H2,1-4H3,(H,14,15)
InChIKeyNNAJCSFKJUBNGS-UHFFFAOYSA-N
XLogP2.74
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-6-[[methyl(propan-2-yl)amino]methyl]pyridin-2-amine
CID 79243333
6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine
CID 79243531
N-[(6-chloro-2-pyridinyl)methyl]-N-methylpentan-3-amine
CID 79240734
N-[[6-(ethylaminomethyl)-2-pyridinyl]methyl]-N-methylpentan-3-amine
CID 106905876
N-methyl-N-[[6-[(2-methylpropylamino)methyl]-2-pyridinyl]methyl]pentan-3-amine
CID 106905878
6-[[methyl(1-methylsulfanylbutan-2-yl)amino]methyl]-N-propylpyridin-2-amine
CID 112664312
6-[[1-(4-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79233617
6-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79234609
N-methyl-6-[[propan-2-yl(propyl)amino]methyl]pyridin-2-amine
CID 79242904
6-[(dibutylamino)methyl]-N-methylpyridin-2-amine
CID 79243168
6-(chloromethyl)-N-methylpyridin-2-amine
CID 90018350
N-methyl-1-methylsulfanyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]butan-2-amine
CID 106907072

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine?
The IUPAC name of N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine (CID 79243618) is N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine is CCC(CC)N(C)Cc1cccc(NC)n1.
What is the InChIKey of N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine?
The InChIKey is NNAJCSFKJUBNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-5-12(6-2)16(4)10-11-8-7-9-13(14-3)15-11/h7-9,12H,5-6,10H2,1-4H3,(H,14,15).
What are the key properties of N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine?
N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine has a molecular weight of 221.35 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine is sourced from PubChem (CID 79243618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).