2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine

C12H20N2O2 — CID 169246607

IUPAC2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine
SMILESCCCc1cc(OC)c(CCN)nc1OC
InChIInChI=1S/C12H20N2O2/c1-4-5-9-8-11(15-2)10(6-7-13)14-12(9)16-3/h8H,4-7,13H2,1-3H3
InChIKeyLAKMEOXJBHMSBH-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.55
Rot. Bonds6

About 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine

2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine (PubChem CID 169246607) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine
PubChem CID169246607
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine
SMILESCCCc1cc(OC)c(CCN)nc1OC
InChIInChI=1S/C12H20N2O2/c1-4-5-9-8-11(15-2)10(6-7-13)14-12(9)16-3/h8H,4-7,13H2,1-3H3
InChIKeyLAKMEOXJBHMSBH-UHFFFAOYSA-N
XLogP1.55
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-fluoro-4-methoxy-2-propylaniline
CID 130537729
2,5-dimethoxy-6-pentylpyridine-3-carbaldehyde
CID 169246548
2-(5-chloro-3-methoxy-2-pyridinyl)ethanamine
CID 84660779
5-(3,3-difluoropropyl)-3-fluoro-6-methoxypyridin-2-amine
CID 164908467
2-(2,6-dimethoxyquinolin-3-yl)ethanamine
CID 170868890
(5-chloro-6-ethyl-2-methoxy-3-pyridinyl)methanamine
CID 105453247
3-(2,5-dimethoxy-4-pentylphenyl)propan-1-amine
CID 176899183
2-(5,6-dimethoxy-3-pyridinyl)ethanamine
CID 66847650
3-(4-methoxy-3-propylphenyl)propan-1-amine
CID 123256997
2-(2-bromo-4-ethoxy-5-methoxyphenyl)ethanamine
CID 170868746
2-(4-ethyl-2-methoxy-5-methylsulfanylphenyl)ethanamine
CID 15915366
[3-(2,5-dimethoxy-4-propylphenyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 117444257

Frequently Asked Questions

What is the IUPAC name of 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine?
The IUPAC name of 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine (CID 169246607) is 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine.
What is the SMILES notation for 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine?
The canonical SMILES for 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine is CCCc1cc(OC)c(CCN)nc1OC.
What is the InChIKey of 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine?
The InChIKey is LAKMEOXJBHMSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-4-5-9-8-11(15-2)10(6-7-13)14-12(9)16-3/h8H,4-7,13H2,1-3H3.
What are the key properties of 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine?
2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine has a molecular weight of 224.30 g/mol, XLogP of 1.55, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,6-dimethoxy-5-propyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 169246607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).