5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine

C12H19N3 — CID 104535281

IUPAC5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine
SMILESCC1(C)CCCC1Nc1cncc(N)c1
InChIInChI=1S/C12H19N3/c1-12(2)5-3-4-11(12)15-10-6-9(13)7-14-8-10/h6-8,11,15H,3-5,13H2,1-2H3
InChIKeyQSZQBEIPJCAJBL-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.65
Rot. Bonds2

About 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine

5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine (PubChem CID 104535281) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine
PubChem CID104535281
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine
SMILESCC1(C)CCCC1Nc1cncc(N)c1
InChIInChI=1S/C12H19N3/c1-12(2)5-3-4-11(12)15-10-6-9(13)7-14-8-10/h6-8,11,15H,3-5,13H2,1-2H3
InChIKeyQSZQBEIPJCAJBL-UHFFFAOYSA-N
XLogP2.65
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine?
The IUPAC name of 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine (CID 104535281) is 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine.
What is the SMILES notation for 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine?
The canonical SMILES for 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine is CC1(C)CCCC1Nc1cncc(N)c1.
What is the InChIKey of 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine?
The InChIKey is QSZQBEIPJCAJBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-12(2)5-3-4-11(12)15-10-6-9(13)7-14-8-10/h6-8,11,15H,3-5,13H2,1-2H3.
What are the key properties of 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine?
5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine has a molecular weight of 205.31 g/mol, XLogP of 2.65, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2,2-dimethylcyclopentyl)pyridine-3,5-diamine is sourced from PubChem (CID 104535281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).