6-chloro-N-cyclopropylpyridin-2-amine

C8H9ClN2 — CID 52911295

IUPAC6-chloro-N-cyclopropylpyridin-2-amine
SMILESClc1cccc(NC2CC2)n1
InChIInChI=1S/C8H9ClN2/c9-7-2-1-3-8(11-7)10-6-4-5-6/h1-3,6H,4-5H2,(H,10,11)
InChIKeyWSFBQKVPUWJIHI-UHFFFAOYSA-N
MW168.63 g/mol
LogP2.31
Rot. Bonds2

About 6-chloro-N-cyclopropylpyridin-2-amine

6-chloro-N-cyclopropylpyridin-2-amine (PubChem CID 52911295) has the molecular formula C8H9ClN2 and a molecular weight of 168.63 g/mol. Its IUPAC name is 6-chloro-N-cyclopropylpyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-cyclopropylpyridin-2-amine
PubChem CID52911295
Molecular FormulaC8H9ClN2
Molecular Weight168.63 g/mol
Exact Mass168.05
IUPAC Name6-chloro-N-cyclopropylpyridin-2-amine
SMILESClc1cccc(NC2CC2)n1
InChIInChI=1S/C8H9ClN2/c9-7-2-1-3-8(11-7)10-6-4-5-6/h1-3,6H,4-5H2,(H,10,11)
InChIKeyWSFBQKVPUWJIHI-UHFFFAOYSA-N
XLogP2.31
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.63
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-cyclopropylpyridin-2-amine?
The IUPAC name of 6-chloro-N-cyclopropylpyridin-2-amine (CID 52911295) is 6-chloro-N-cyclopropylpyridin-2-amine.
What is the SMILES notation for 6-chloro-N-cyclopropylpyridin-2-amine?
The canonical SMILES for 6-chloro-N-cyclopropylpyridin-2-amine is Clc1cccc(NC2CC2)n1.
What is the InChIKey of 6-chloro-N-cyclopropylpyridin-2-amine?
The InChIKey is WSFBQKVPUWJIHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2/c9-7-2-1-3-8(11-7)10-6-4-5-6/h1-3,6H,4-5H2,(H,10,11).
What are the key properties of 6-chloro-N-cyclopropylpyridin-2-amine?
6-chloro-N-cyclopropylpyridin-2-amine has a molecular weight of 168.63 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-cyclopropylpyridin-2-amine is sourced from PubChem (CID 52911295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).