4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine

C13H23N3O — CID 116718992

IUPAC4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine
SMILESCCCC(OC)C(Cc1ccnc(N)c1)NC
InChIInChI=1S/C13H23N3O/c1-4-5-12(17-3)11(15-2)8-10-6-7-16-13(14)9-10/h6-7,9,11-12,15H,4-5,8H2,1-3H3,(H2,14,16)
InChIKeyGJIQZIBKVVIMDW-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.61
Rot. Bonds7

About 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine

4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine (PubChem CID 116718992) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine
PubChem CID116718992
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine
SMILESCCCC(OC)C(Cc1ccnc(N)c1)NC
InChIInChI=1S/C13H23N3O/c1-4-5-12(17-3)11(15-2)8-10-6-7-16-13(14)9-10/h6-7,9,11-12,15H,4-5,8H2,1-3H3,(H2,14,16)
InChIKeyGJIQZIBKVVIMDW-UHFFFAOYSA-N
XLogP1.61
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-methoxy-2-(propylamino)hexyl]pyridin-2-amine
CID 116719566
3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine
CID 116718922
4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine
CID 65091866
4-[3-ethoxy-2-(propylamino)butyl]pyridin-2-amine
CID 64533806
4-[2-(methylamino)-3-propylsulfanylpropyl]pyridin-2-amine
CID 65129317
4-(2-hydrazinyl-3-methoxy-3-phenylpropyl)pyridin-2-amine
CID 105279076
4-(2-amino-3-methoxybutyl)pyridin-2-amine
CID 79615950
4-(3-ethoxy-2-hydrazinylpropyl)pyridin-2-amine
CID 105235296
4-[4-ethoxy-2-(propylamino)butyl]pyridin-2-amine
CID 106815088
4-[3-propan-2-ylsulfanyl-2-(propylamino)propyl]pyridin-2-amine
CID 65132138
4-(2-hydrazinylpropyl)pyridin-2-amine
CID 105201271
[1-(4-ethylphenyl)-3-methoxyhexan-2-yl]hydrazine
CID 105271593

Frequently Asked Questions

What is the IUPAC name of 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine?
The IUPAC name of 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine (CID 116718992) is 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine.
What is the SMILES notation for 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine?
The canonical SMILES for 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine is CCCC(OC)C(Cc1ccnc(N)c1)NC.
What is the InChIKey of 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine?
The InChIKey is GJIQZIBKVVIMDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-4-5-12(17-3)11(15-2)8-10-6-7-16-13(14)9-10/h6-7,9,11-12,15H,4-5,8H2,1-3H3,(H2,14,16).
What are the key properties of 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine?
4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine has a molecular weight of 237.35 g/mol, XLogP of 1.61, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine is sourced from PubChem (CID 116718992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).