6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine

C12H20N4 — CID 79827207

IUPAC6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine
SMILESCC1CCC(Nc2ccc(N)c(N)n2)C1C
InChIInChI=1S/C12H20N4/c1-7-3-5-10(8(7)2)15-11-6-4-9(13)12(14)16-11/h4,6-8,10H,3,5,13H2,1-2H3,(H3,14,15,16)
InChIKeySQQJTRGGZRVTPU-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.09
Rot. Bonds2

About 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine

6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine (PubChem CID 79827207) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine.

Molecular Properties

Compound Name6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine
PubChem CID79827207
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine
SMILESCC1CCC(Nc2ccc(N)c(N)n2)C1C
InChIInChI=1S/C12H20N4/c1-7-3-5-10(8(7)2)15-11-6-4-9(13)12(14)16-11/h4,6-8,10H,3,5,13H2,1-2H3,(H3,14,15,16)
InChIKeySQQJTRGGZRVTPU-UHFFFAOYSA-N
XLogP2.09
TPSA76.96 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(2,3-dimethylcyclohexyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 43261108
2-[(5,6-diamino-2-pyridinyl)amino]cyclohexan-1-ol
CID 79827031
N-(2,3-dimethylcyclopentyl)-6-hydrazinyl-2-methylpyrimidin-4-amine
CID 80915271
6-N-cyclohexylpyridine-2,3,6-triamine
CID 79823249
4-N-(2,3-dimethylcyclopentyl)-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114565274
N-(2,3-dimethylcyclopentyl)-6-methoxypyridin-2-amine
CID 64921430
3-N-(2,3-dimethylcyclopentyl)quinoxaline-2,3-diamine
CID 102984543
4-N-(2,3-dimethylcyclopentyl)-2-phenylpyrimidine-4,6-diamine
CID 115915661
N-(2,3-dimethylcyclopentyl)-6-hydrazinylpyrazin-2-amine
CID 80915676
4-[(5,6-diamino-2-pyridinyl)amino]cyclohexan-1-ol
CID 79822536
6-N-(2,3-dimethylcyclopentyl)-2-N-propylpyridine-2,6-diamine
CID 80840395
6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine
CID 79826028

Frequently Asked Questions

What is the IUPAC name of 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine?
The IUPAC name of 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine (CID 79827207) is 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine.
What is the SMILES notation for 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine?
The canonical SMILES for 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine is CC1CCC(Nc2ccc(N)c(N)n2)C1C.
What is the InChIKey of 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine?
The InChIKey is SQQJTRGGZRVTPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-7-3-5-10(8(7)2)15-11-6-4-9(13)12(14)16-11/h4,6-8,10H,3,5,13H2,1-2H3,(H3,14,15,16).
What are the key properties of 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine?
6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine has a molecular weight of 220.32 g/mol, XLogP of 2.09, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2,3-dimethylcyclopentyl)pyridine-2,3,6-triamine is sourced from PubChem (CID 79827207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).