6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine

C11H15ClN2 — CID 62255015

IUPAC6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine
SMILESCCN(c1cccc(CCl)n1)C1CC1
InChIInChI=1S/C11H15ClN2/c1-2-14(10-6-7-10)11-5-3-4-9(8-12)13-11/h3-5,10H,2,6-8H2,1H3
InChIKeyHZLXBXBHFZGDFM-UHFFFAOYSA-N
MW210.71 g/mol
LogP2.81
Rot. Bonds4

About 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine

6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine (PubChem CID 62255015) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine
PubChem CID62255015
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine
SMILESCCN(c1cccc(CCl)n1)C1CC1
InChIInChI=1S/C11H15ClN2/c1-2-14(10-6-7-10)11-5-3-4-9(8-12)13-11/h3-5,10H,2,6-8H2,1H3
InChIKeyHZLXBXBHFZGDFM-UHFFFAOYSA-N
XLogP2.81
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine?
The IUPAC name of 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine (CID 62255015) is 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine?
The canonical SMILES for 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine is CCN(c1cccc(CCl)n1)C1CC1.
What is the InChIKey of 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine?
The InChIKey is HZLXBXBHFZGDFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2/c1-2-14(10-6-7-10)11-5-3-4-9(8-12)13-11/h3-5,10H,2,6-8H2,1H3.
What are the key properties of 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine?
6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine has a molecular weight of 210.71 g/mol, XLogP of 2.81, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine is sourced from PubChem (CID 62255015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).