5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide

C9H16BrN3O — CID 6602536

IUPAC5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide
SMILESBr.COCc1c(CN)cnc(C)c1N
InChIInChI=1S/C9H15N3O.BrH/c1-6-9(11)8(5-13-2)7(3-10)4-12-6;/h4H,3,5,10-11H2,1-2H3;1H
InChIKeyORWNZAVJUXGXTM-UHFFFAOYSA-N
MW262.15 g/mol
LogP1.16
Rot. Bonds3

About 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide

5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide (PubChem CID 6602536) has the molecular formula C9H16BrN3O and a molecular weight of 262.15 g/mol. Its IUPAC name is 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide.

Molecular Properties

Compound Name5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide
PubChem CID6602536
Molecular FormulaC9H16BrN3O
Molecular Weight262.15 g/mol
Exact Mass261.05
IUPAC Name5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide
SMILESBr.COCc1c(CN)cnc(C)c1N
InChIInChI=1S/C9H15N3O.BrH/c1-6-9(11)8(5-13-2)7(3-10)4-12-6;/h4H,3,5,10-11H2,1-2H3;1H
InChIKeyORWNZAVJUXGXTM-UHFFFAOYSA-N
XLogP1.16
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.15
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide?
The IUPAC name of 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide (CID 6602536) is 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide.
What is the SMILES notation for 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide?
The canonical SMILES for 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide is Br.COCc1c(CN)cnc(C)c1N.
What is the InChIKey of 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide?
The InChIKey is ORWNZAVJUXGXTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O.BrH/c1-6-9(11)8(5-13-2)7(3-10)4-12-6;/h4H,3,5,10-11H2,1-2H3;1H.
What are the key properties of 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide?
5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide has a molecular weight of 262.15 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-4-(methoxymethyl)-2-methylpyridin-3-amine;hydrobromide is sourced from PubChem (CID 6602536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).