3-chloro-N-cyclobutylpyridin-2-amine

C9H11ClN2 — CID 62414981

IUPAC3-chloro-N-cyclobutylpyridin-2-amine
SMILESClc1cccnc1NC1CCC1
InChIInChI=1S/C9H11ClN2/c10-8-5-2-6-11-9(8)12-7-3-1-4-7/h2,5-7H,1,3-4H2,(H,11,12)
InChIKeyISSNPIPSIYLFIF-UHFFFAOYSA-N
MW182.65 g/mol
LogP2.70
Rot. Bonds2

About 3-chloro-N-cyclobutylpyridin-2-amine

3-chloro-N-cyclobutylpyridin-2-amine (PubChem CID 62414981) has the molecular formula C9H11ClN2 and a molecular weight of 182.65 g/mol. Its IUPAC name is 3-chloro-N-cyclobutylpyridin-2-amine.

Molecular Properties

Compound Name3-chloro-N-cyclobutylpyridin-2-amine
PubChem CID62414981
Molecular FormulaC9H11ClN2
Molecular Weight182.65 g/mol
Exact Mass182.06
IUPAC Name3-chloro-N-cyclobutylpyridin-2-amine
SMILESClc1cccnc1NC1CCC1
InChIInChI=1S/C9H11ClN2/c10-8-5-2-6-11-9(8)12-7-3-1-4-7/h2,5-7H,1,3-4H2,(H,11,12)
InChIKeyISSNPIPSIYLFIF-UHFFFAOYSA-N
XLogP2.70
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.65
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-cyclobutylpyridin-2-amine?
The IUPAC name of 3-chloro-N-cyclobutylpyridin-2-amine (CID 62414981) is 3-chloro-N-cyclobutylpyridin-2-amine.
What is the SMILES notation for 3-chloro-N-cyclobutylpyridin-2-amine?
The canonical SMILES for 3-chloro-N-cyclobutylpyridin-2-amine is Clc1cccnc1NC1CCC1.
What is the InChIKey of 3-chloro-N-cyclobutylpyridin-2-amine?
The InChIKey is ISSNPIPSIYLFIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2/c10-8-5-2-6-11-9(8)12-7-3-1-4-7/h2,5-7H,1,3-4H2,(H,11,12).
What are the key properties of 3-chloro-N-cyclobutylpyridin-2-amine?
3-chloro-N-cyclobutylpyridin-2-amine has a molecular weight of 182.65 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-cyclobutylpyridin-2-amine is sourced from PubChem (CID 62414981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).