4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine

C10H16N2O3 — CID 155587851

IUPAC4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine
SMILESCOCC(COC)Oc1ccnc(N)c1
InChIInChI=1S/C10H16N2O3/c1-13-6-9(7-14-2)15-8-3-4-12-10(11)5-8/h3-5,9H,6-7H2,1-2H3,(H2,11,12)
InChIKeyYAFZEYPNZCAWKF-UHFFFAOYSA-N
MW212.25 g/mol
LogP0.70
Rot. Bonds6

About 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine

4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine (PubChem CID 155587851) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine.

Molecular Properties

Compound Name4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine
PubChem CID155587851
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine
SMILESCOCC(COC)Oc1ccnc(N)c1
InChIInChI=1S/C10H16N2O3/c1-13-6-9(7-14-2)15-8-3-4-12-10(11)5-8/h3-5,9H,6-7H2,1-2H3,(H2,11,12)
InChIKeyYAFZEYPNZCAWKF-UHFFFAOYSA-N
XLogP0.70
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine?
The IUPAC name of 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine (CID 155587851) is 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine.
What is the SMILES notation for 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine?
The canonical SMILES for 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine is COCC(COC)Oc1ccnc(N)c1.
What is the InChIKey of 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine?
The InChIKey is YAFZEYPNZCAWKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-13-6-9(7-14-2)15-8-3-4-12-10(11)5-8/h3-5,9H,6-7H2,1-2H3,(H2,11,12).
What are the key properties of 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine?
4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine has a molecular weight of 212.25 g/mol, XLogP of 0.70, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-dimethoxypropan-2-yloxy)pyridin-2-amine is sourced from PubChem (CID 155587851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).