3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine

C11H15ClN2 — CID 64515650

IUPAC3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(C2CCC(Cl)C2)c1
InChIInChI=1S/C11H15ClN2/c1-7-4-10(11(13)14-6-7)8-2-3-9(12)5-8/h4,6,8-9H,2-3,5H2,1H3,(H2,13,14)
InChIKeyWRFBDNNETJMMOE-UHFFFAOYSA-N
MW210.71 g/mol
LogP2.85
Rot. Bonds1

About 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine

3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine (PubChem CID 64515650) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine
PubChem CID64515650
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(C2CCC(Cl)C2)c1
InChIInChI=1S/C11H15ClN2/c1-7-4-10(11(13)14-6-7)8-2-3-9(12)5-8/h4,6,8-9H,2-3,5H2,1H3,(H2,13,14)
InChIKeyWRFBDNNETJMMOE-UHFFFAOYSA-N
XLogP2.85
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine?
The IUPAC name of 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine (CID 64515650) is 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine.
What is the SMILES notation for 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine?
The canonical SMILES for 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine is Cc1cnc(N)c(C2CCC(Cl)C2)c1.
What is the InChIKey of 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine?
The InChIKey is WRFBDNNETJMMOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2/c1-7-4-10(11(13)14-6-7)8-2-3-9(12)5-8/h4,6,8-9H,2-3,5H2,1H3,(H2,13,14).
What are the key properties of 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine?
3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine has a molecular weight of 210.71 g/mol, XLogP of 2.85, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorocyclopentyl)-5-methylpyridin-2-amine is sourced from PubChem (CID 64515650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).