5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine

C14H24ClN3 — CID 62282594

IUPAC5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine
SMILESCCCC(C)N(C)c1ccc(Cl)c(CNCC)n1
InChIInChI=1S/C14H24ClN3/c1-5-7-11(3)18(4)14-9-8-12(15)13(17-14)10-16-6-2/h8-9,11,16H,5-7,10H2,1-4H3
InChIKeyGQDRESMXGPZIJO-UHFFFAOYSA-N
MW269.82 g/mol
LogP3.47
Rot. Bonds7

About 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine

5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine (PubChem CID 62282594) has the molecular formula C14H24ClN3 and a molecular weight of 269.82 g/mol. Its IUPAC name is 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine
PubChem CID62282594
Molecular FormulaC14H24ClN3
Molecular Weight269.82 g/mol
Exact Mass269.17
IUPAC Name5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine
SMILESCCCC(C)N(C)c1ccc(Cl)c(CNCC)n1
InChIInChI=1S/C14H24ClN3/c1-5-7-11(3)18(4)14-9-8-12(15)13(17-14)10-16-6-2/h8-9,11,16H,5-7,10H2,1-4H3
InChIKeyGQDRESMXGPZIJO-UHFFFAOYSA-N
XLogP3.47
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.82
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine?
The IUPAC name of 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine (CID 62282594) is 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine.
What is the SMILES notation for 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine?
The canonical SMILES for 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine is CCCC(C)N(C)c1ccc(Cl)c(CNCC)n1.
What is the InChIKey of 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine?
The InChIKey is GQDRESMXGPZIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24ClN3/c1-5-7-11(3)18(4)14-9-8-12(15)13(17-14)10-16-6-2/h8-9,11,16H,5-7,10H2,1-4H3.
What are the key properties of 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine?
5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine has a molecular weight of 269.82 g/mol, XLogP of 3.47, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine is sourced from PubChem (CID 62282594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).