5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine

C12H18ClN3 — CID 83026801

IUPAC5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine
SMILESCC1CCCC(C)N1Nc1ccc(Cl)cn1
InChIInChI=1S/C12H18ClN3/c1-9-4-3-5-10(2)16(9)15-12-7-6-11(13)8-14-12/h6-10H,3-5H2,1-2H3,(H,14,15)
InChIKeyINIQCYCIVUJOMX-UHFFFAOYSA-N
MW239.75 g/mol
LogP3.32
Rot. Bonds2

About 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine

5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine (PubChem CID 83026801) has the molecular formula C12H18ClN3 and a molecular weight of 239.75 g/mol. Its IUPAC name is 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine
PubChem CID83026801
Molecular FormulaC12H18ClN3
Molecular Weight239.75 g/mol
Exact Mass239.12
IUPAC Name5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine
SMILESCC1CCCC(C)N1Nc1ccc(Cl)cn1
InChIInChI=1S/C12H18ClN3/c1-9-4-3-5-10(2)16(9)15-12-7-6-11(13)8-14-12/h6-10H,3-5H2,1-2H3,(H,14,15)
InChIKeyINIQCYCIVUJOMX-UHFFFAOYSA-N
XLogP3.32
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.75
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine?
The IUPAC name of 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine (CID 83026801) is 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine?
The canonical SMILES for 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine is CC1CCCC(C)N1Nc1ccc(Cl)cn1.
What is the InChIKey of 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine?
The InChIKey is INIQCYCIVUJOMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN3/c1-9-4-3-5-10(2)16(9)15-12-7-6-11(13)8-14-12/h6-10H,3-5H2,1-2H3,(H,14,15).
What are the key properties of 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine?
5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine has a molecular weight of 239.75 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine is sourced from PubChem (CID 83026801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).