6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine

C13H22N4 — CID 80647391

IUPAC6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine
SMILESCC1CCN(CCNc2cccc(N)n2)CC1
InChIInChI=1S/C13H22N4/c1-11-5-8-17(9-6-11)10-7-15-13-4-2-3-12(14)16-13/h2-4,11H,5-10H2,1H3,(H3,14,15,16)
InChIKeyMBPQYMFKMOGTFE-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.81
Rot. Bonds4

About 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine

6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine (PubChem CID 80647391) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine
PubChem CID80647391
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine
SMILESCC1CCN(CCNc2cccc(N)n2)CC1
InChIInChI=1S/C13H22N4/c1-11-5-8-17(9-6-11)10-7-15-13-4-2-3-12(14)16-13/h2-4,11H,5-10H2,1H3,(H3,14,15,16)
InChIKeyMBPQYMFKMOGTFE-UHFFFAOYSA-N
XLogP1.81
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-(3-pyrrolidin-1-ylpropyl)pyridine-2,6-diamine
CID 80646711
5-tert-butyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine
CID 107874553
6-N-[(1-methylpiperidin-4-yl)methyl]pyridine-2,6-diamine
CID 80647279
6-N-[(1-ethylpyrrolidin-3-yl)methyl]pyridine-2,6-diamine
CID 80646581
6-bromo-2-tert-butyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine
CID 106193958
2-N-methyl-6-N-(2-pyrrolidin-1-ylethyl)pyridine-2,6-diamine
CID 80832526
6-N-[2-(methylamino)ethyl]pyridine-2,6-diamine
CID 10888283
6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine
CID 61241263
6-methoxy-2-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,3-diamine
CID 115320489
2-[(6-amino-2-pyridinyl)amino]ethanol
CID 66907238
6-N-(2-cyclopentyloxyethyl)pyridine-2,6-diamine
CID 80647858
6-chloro-N-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine
CID 106193946

Frequently Asked Questions

What is the IUPAC name of 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine?
The IUPAC name of 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine (CID 80647391) is 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine.
What is the SMILES notation for 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine?
The canonical SMILES for 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine is CC1CCN(CCNc2cccc(N)n2)CC1.
What is the InChIKey of 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine?
The InChIKey is MBPQYMFKMOGTFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-11-5-8-17(9-6-11)10-7-15-13-4-2-3-12(14)16-13/h2-4,11H,5-10H2,1H3,(H3,14,15,16).
What are the key properties of 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine?
6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine has a molecular weight of 234.35 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridine-2,6-diamine is sourced from PubChem (CID 80647391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).