N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine

C18H26N4 — CID 91090373

IUPACN-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
SMILESCN(Cc1ccccn1)Cc1cccc(NCC(C)(C)C)n1
InChIInChI=1S/C18H26N4/c1-18(2,3)14-20-17-10-7-9-16(21-17)13-22(4)12-15-8-5-6-11-19-15/h5-11H,12-14H2,1-4H3,(H,20,21)
InChIKeyRYTMHYRFPGUKGZ-UHFFFAOYSA-N
MW298.43 g/mol
LogP3.57
Rot. Bonds6

About N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine

N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine (PubChem CID 91090373) has the molecular formula C18H26N4 and a molecular weight of 298.43 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
PubChem CID91090373
Molecular FormulaC18H26N4
Molecular Weight298.43 g/mol
Exact Mass298.22
IUPAC NameN-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
SMILESCN(Cc1ccccn1)Cc1cccc(NCC(C)(C)C)n1
InChIInChI=1S/C18H26N4/c1-18(2,3)14-20-17-10-7-9-16(21-17)13-22(4)12-15-8-5-6-11-19-15/h5-11H,12-14H2,1-4H3,(H,20,21)
InChIKeyRYTMHYRFPGUKGZ-UHFFFAOYSA-N
XLogP3.57
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine?
The IUPAC name of N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine (CID 91090373) is N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine.
What is the SMILES notation for N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine?
The canonical SMILES for N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine is CN(Cc1ccccn1)Cc1cccc(NCC(C)(C)C)n1.
What is the InChIKey of N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine?
The InChIKey is RYTMHYRFPGUKGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4/c1-18(2,3)14-20-17-10-7-9-16(21-17)13-22(4)12-15-8-5-6-11-19-15/h5-11H,12-14H2,1-4H3,(H,20,21).
What are the key properties of N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine?
N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine has a molecular weight of 298.43 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine is sourced from PubChem (CID 91090373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).