2-N-(2-methylcyclopentyl)pyridine-2,3-diamine

C11H17N3 — CID 63278381

IUPAC2-N-(2-methylcyclopentyl)pyridine-2,3-diamine
SMILESCC1CCCC1Nc1ncccc1N
InChIInChI=1S/C11H17N3/c1-8-4-2-6-10(8)14-11-9(12)5-3-7-13-11/h3,5,7-8,10H,2,4,6,12H2,1H3,(H,13,14)
InChIKeyKEIGBSUZLQPRLH-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.26
Rot. Bonds2

About 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine

2-N-(2-methylcyclopentyl)pyridine-2,3-diamine (PubChem CID 63278381) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(2-methylcyclopentyl)pyridine-2,3-diamine
PubChem CID63278381
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-N-(2-methylcyclopentyl)pyridine-2,3-diamine
SMILESCC1CCCC1Nc1ncccc1N
InChIInChI=1S/C11H17N3/c1-8-4-2-6-10(8)14-11-9(12)5-3-7-13-11/h3,5,7-8,10H,2,4,6,12H2,1H3,(H,13,14)
InChIKeyKEIGBSUZLQPRLH-UHFFFAOYSA-N
XLogP2.26
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine?
The IUPAC name of 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine (CID 63278381) is 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine.
What is the SMILES notation for 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine?
The canonical SMILES for 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine is CC1CCCC1Nc1ncccc1N.
What is the InChIKey of 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine?
The InChIKey is KEIGBSUZLQPRLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-8-4-2-6-10(8)14-11-9(12)5-3-7-13-11/h3,5,7-8,10H,2,4,6,12H2,1H3,(H,13,14).
What are the key properties of 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine?
2-N-(2-methylcyclopentyl)pyridine-2,3-diamine has a molecular weight of 191.28 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-methylcyclopentyl)pyridine-2,3-diamine is sourced from PubChem (CID 63278381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).