2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine

C13H22N4 — CID 114503076

IUPAC2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine
SMILESCc1nc(NC2CCN(C)CC2C)ccc1N
InChIInChI=1S/C13H22N4/c1-9-8-17(3)7-6-12(9)16-13-5-4-11(14)10(2)15-13/h4-5,9,12H,6-8,14H2,1-3H3,(H,15,16)
InChIKeyXTZCKEOTLRTTAB-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.72
Rot. Bonds2

About 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine

2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine (PubChem CID 114503076) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine
PubChem CID114503076
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine
SMILESCc1nc(NC2CCN(C)CC2C)ccc1N
InChIInChI=1S/C13H22N4/c1-9-8-17(3)7-6-12(9)16-13-5-4-11(14)10(2)15-13/h4-5,9,12H,6-8,14H2,1-3H3,(H,15,16)
InChIKeyXTZCKEOTLRTTAB-UHFFFAOYSA-N
XLogP1.72
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(1,3-dimethylpiperidin-4-yl)pyridine-2,5-diamine
CID 114502996
2-cyclopropyl-N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinylpyrimidin-4-amine
CID 114506697
6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine
CID 79826028
3-N-(1,3-dimethylpiperidin-4-yl)-5-methylbenzene-1,3-diamine
CID 114502993
4-N-(1,3-dimethylpiperidin-4-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 114506573
8-N-(1,3-dimethylpiperidin-4-yl)quinoline-5,8-diamine
CID 114502970
6-methyl-2-N-[2-(1-methylpiperidin-3-yl)ethyl]pyridine-2,5-diamine
CID 115147756
(3R,4S)-1,3-dimethyl-N-phenylpiperidin-4-amine
CID 15541148
4-N-(1,3-dimethylpiperidin-4-yl)-6-N-ethyl-2-propylpyrimidine-4,6-diamine
CID 114506472
N-(1,3-dimethylpiperidin-4-yl)-2-hydrazinylpyridin-4-amine
CID 114506746
5-amino-N-(1,3-dimethylpiperidin-4-yl)-2-methylpyridine-3-carboxamide
CID 114502792
2-[(1,3-dimethylpiperidin-4-yl)amino]-6-propan-2-ylpyridine-4-carboxylic acid
CID 114504534

Frequently Asked Questions

What is the IUPAC name of 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine?
The IUPAC name of 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine (CID 114503076) is 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine?
The canonical SMILES for 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine is Cc1nc(NC2CCN(C)CC2C)ccc1N.
What is the InChIKey of 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine?
The InChIKey is XTZCKEOTLRTTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-9-8-17(3)7-6-12(9)16-13-5-4-11(14)10(2)15-13/h4-5,9,12H,6-8,14H2,1-3H3,(H,15,16).
What are the key properties of 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine?
2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine has a molecular weight of 234.35 g/mol, XLogP of 1.72, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine is sourced from PubChem (CID 114503076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).