6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine

C11H20N4 — CID 80778351

IUPAC6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine
SMILESCNc1cccc(NCCCN(C)C)n1
InChIInChI=1S/C11H20N4/c1-12-10-6-4-7-11(14-10)13-8-5-9-15(2)3/h4,6-7H,5,8-9H2,1-3H3,(H2,12,13,14)
InChIKeyMRUNABWMVGQYPL-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.49
Rot. Bonds6

About 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine

6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine (PubChem CID 80778351) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine
PubChem CID80778351
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine
SMILESCNc1cccc(NCCCN(C)C)n1
InChIInChI=1S/C11H20N4/c1-12-10-6-4-7-11(14-10)13-8-5-9-15(2)3/h4,6-7H,5,8-9H2,1-3H3,(H2,12,13,14)
InChIKeyMRUNABWMVGQYPL-UHFFFAOYSA-N
XLogP1.49
TPSA40.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine
CID 60876998
N-(6-fluoro-2-pyridinyl)-N',N'-dimethylpropane-1,3-diamine
CID 61228791
5-[[6-(methylamino)-2-pyridinyl]amino]pentanamide
CID 106241556
2-N-methyl-6-N-(2-methylsulfanylethyl)pyridine-2,6-diamine
CID 80839882
N-(6-fluoro-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine
CID 61229371
N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
CID 63725681
2-N,6-N-dipentylpyridine-2,6-diamine
CID 66709787
6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 80871017
6-N-methyl-2-N-[3-(N-methylanilino)propyl]pyrazine-2,6-diamine
CID 80784811
N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine
CID 80944940
4-N-[4-(dimethylamino)butyl]-6-N-methylpyrimidine-2,4,6-triamine
CID 80817210
6-N-[3-(dimethylamino)propyl]-6-N-ethyl-2-N-propylpyridine-2,6-diamine
CID 102998825

Frequently Asked Questions

What is the IUPAC name of 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine?
The IUPAC name of 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine (CID 80778351) is 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine?
The canonical SMILES for 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine is CNc1cccc(NCCCN(C)C)n1.
What is the InChIKey of 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine?
The InChIKey is MRUNABWMVGQYPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-12-10-6-4-7-11(14-10)13-8-5-9-15(2)3/h4,6-7H,5,8-9H2,1-3H3,(H2,12,13,14).
What are the key properties of 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine?
6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine has a molecular weight of 208.31 g/mol, XLogP of 1.49, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine is sourced from PubChem (CID 80778351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).