5-chloro-6-propylpyridin-3-amine

C8H11ClN2 — CID 126979651

IUPAC5-chloro-6-propylpyridin-3-amine
SMILESCCCc1ncc(N)cc1Cl
InChIInChI=1S/C8H11ClN2/c1-2-3-8-7(9)4-6(10)5-11-8/h4-5H,2-3,10H2,1H3
InChIKeySIPWBFZMNBUDJL-UHFFFAOYSA-N
MW170.64 g/mol
LogP2.27
Rot. Bonds2

About 5-chloro-6-propylpyridin-3-amine

5-chloro-6-propylpyridin-3-amine (PubChem CID 126979651) has the molecular formula C8H11ClN2 and a molecular weight of 170.64 g/mol. Its IUPAC name is 5-chloro-6-propylpyridin-3-amine.

Molecular Properties

Compound Name5-chloro-6-propylpyridin-3-amine
PubChem CID126979651
Molecular FormulaC8H11ClN2
Molecular Weight170.64 g/mol
Exact Mass170.06
IUPAC Name5-chloro-6-propylpyridin-3-amine
SMILESCCCc1ncc(N)cc1Cl
InChIInChI=1S/C8H11ClN2/c1-2-3-8-7(9)4-6(10)5-11-8/h4-5H,2-3,10H2,1H3
InChIKeySIPWBFZMNBUDJL-UHFFFAOYSA-N
XLogP2.27
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.64
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-propylpyridin-3-amine?
The IUPAC name of 5-chloro-6-propylpyridin-3-amine (CID 126979651) is 5-chloro-6-propylpyridin-3-amine.
What is the SMILES notation for 5-chloro-6-propylpyridin-3-amine?
The canonical SMILES for 5-chloro-6-propylpyridin-3-amine is CCCc1ncc(N)cc1Cl.
What is the InChIKey of 5-chloro-6-propylpyridin-3-amine?
The InChIKey is SIPWBFZMNBUDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2/c1-2-3-8-7(9)4-6(10)5-11-8/h4-5H,2-3,10H2,1H3.
What are the key properties of 5-chloro-6-propylpyridin-3-amine?
5-chloro-6-propylpyridin-3-amine has a molecular weight of 170.64 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-propylpyridin-3-amine is sourced from PubChem (CID 126979651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).