1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine

C10H16N2O2 — CID 169246630

IUPAC1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine
SMILESCOc1ccc(OC)c(CC(C)N)n1
InChIInChI=1S/C10H16N2O2/c1-7(11)6-8-9(13-2)4-5-10(12-8)14-3/h4-5,7H,6,11H2,1-3H3
InChIKeyUSWGFSWDXZINCU-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.99
Rot. Bonds4

About 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine

1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine (PubChem CID 169246630) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine.

Molecular Properties

Compound Name1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine
PubChem CID169246630
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine
SMILESCOc1ccc(OC)c(CC(C)N)n1
InChIInChI=1S/C10H16N2O2/c1-7(11)6-8-9(13-2)4-5-10(12-8)14-3/h4-5,7H,6,11H2,1-3H3
InChIKeyUSWGFSWDXZINCU-UHFFFAOYSA-N
XLogP0.99
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine?
The IUPAC name of 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine (CID 169246630) is 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine.
What is the SMILES notation for 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine?
The canonical SMILES for 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine is COc1ccc(OC)c(CC(C)N)n1.
What is the InChIKey of 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine?
The InChIKey is USWGFSWDXZINCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7(11)6-8-9(13-2)4-5-10(12-8)14-3/h4-5,7H,6,11H2,1-3H3.
What are the key properties of 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine?
1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine has a molecular weight of 196.25 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,6-dimethoxy-2-pyridinyl)propan-2-amine is sourced from PubChem (CID 169246630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).