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

C13H23N3O — CID 116718922

IUPAC3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine
SMILESCCCC(OC)C(Cc1cccnc1N)NC
InChIInChI=1S/C13H23N3O/c1-4-6-12(17-3)11(15-2)9-10-7-5-8-16-13(10)14/h5,7-8,11-12,15H,4,6,9H2,1-3H3,(H2,14,16)
InChIKeyMNVDHIDYOIEUOL-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.61
Rot. Bonds7

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

3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine (PubChem CID 116718922) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine
PubChem CID116718922
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine
SMILESCCCC(OC)C(Cc1cccnc1N)NC
InChIInChI=1S/C13H23N3O/c1-4-6-12(17-3)11(15-2)9-10-7-5-8-16-13(10)14/h5,7-8,11-12,15H,4,6,9H2,1-3H3,(H2,14,16)
InChIKeyMNVDHIDYOIEUOL-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-(methylamino)hexyl]pyridin-2-amine
CID 116718992
1-(2-amino-3-pyridinyl)-3-ethoxybutan-2-ol
CID 64541569
1-(5-fluoro-2-methylphenyl)-3-methoxy-N-methylhexan-2-amine
CID 105374363
3-(2-methylpropyl)pyridin-2-amine
CID 20771927
3-[2-methyl-3-(methylamino)propyl]pyridin-2-amine
CID 64664973
3-methoxy-N-methyl-1-pyridin-2-ylpentan-2-amine
CID 116715417
3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine
CID 103374238
3-(2-hydrazinyl-3-propan-2-ylsulfanylpropyl)pyridin-2-amine
CID 105226241
3-[3-ethoxy-3-methyl-2-(propylamino)pentyl]pyridin-2-amine
CID 116759404
ethane;3-propylpyridin-2-amine
CID 176926436
3-[3-(dimethylamino)-3-ethyl-2-hydrazinylpentyl]pyridin-2-amine
CID 105241861
3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-2-amine
CID 105190972

Frequently Asked Questions

What is the IUPAC name of 3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine?
The IUPAC name of 3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine (CID 116718922) is 3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine.
What is the SMILES notation for 3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine?
The canonical SMILES for 3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine is CCCC(OC)C(Cc1cccnc1N)NC.
What is the InChIKey of 3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine?
The InChIKey is MNVDHIDYOIEUOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-4-6-12(17-3)11(15-2)9-10-7-5-8-16-13(10)14/h5,7-8,11-12,15H,4,6,9H2,1-3H3,(H2,14,16).
What are the key properties of 3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine?
3-[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 3-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine is sourced from PubChem (CID 116718922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).