5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine

C10H15ClN2O2 — CID 62886850

IUPAC5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine
SMILESCOCCCOCc1nc(N)ccc1Cl
InChIInChI=1S/C10H15ClN2O2/c1-14-5-2-6-15-7-9-8(11)3-4-10(12)13-9/h3-4H,2,5-7H2,1H3,(H2,12,13)
InChIKeyGAGNARXQLMPWDX-UHFFFAOYSA-N
MW230.69 g/mol
LogP1.87
Rot. Bonds6

About 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine

5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine (PubChem CID 62886850) has the molecular formula C10H15ClN2O2 and a molecular weight of 230.69 g/mol. Its IUPAC name is 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine
PubChem CID62886850
Molecular FormulaC10H15ClN2O2
Molecular Weight230.69 g/mol
Exact Mass230.08
IUPAC Name5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine
SMILESCOCCCOCc1nc(N)ccc1Cl
InChIInChI=1S/C10H15ClN2O2/c1-14-5-2-6-15-7-9-8(11)3-4-10(12)13-9/h3-4H,2,5-7H2,1H3,(H2,12,13)
InChIKeyGAGNARXQLMPWDX-UHFFFAOYSA-N
XLogP1.87
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.69
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine?
The IUPAC name of 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine (CID 62886850) is 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine is COCCCOCc1nc(N)ccc1Cl.
What is the InChIKey of 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine?
The InChIKey is GAGNARXQLMPWDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O2/c1-14-5-2-6-15-7-9-8(11)3-4-10(12)13-9/h3-4H,2,5-7H2,1H3,(H2,12,13).
What are the key properties of 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine?
5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine has a molecular weight of 230.69 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(3-methoxypropoxymethyl)pyridin-2-amine is sourced from PubChem (CID 62886850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).