2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine

C10H16N2O — CID 130543295

IUPAC2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine
SMILESCOc1ncccc1C(C)(C)CN
InChIInChI=1S/C10H16N2O/c1-10(2,7-11)8-5-4-6-12-9(8)13-3/h4-6H,7,11H2,1-3H3
InChIKeyUOEJOCQODMKDSA-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.33
Rot. Bonds3

About 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine

2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine (PubChem CID 130543295) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine
PubChem CID130543295
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine
SMILESCOc1ncccc1C(C)(C)CN
InChIInChI=1S/C10H16N2O/c1-10(2,7-11)8-5-4-6-12-9(8)13-3/h4-6H,7,11H2,1-3H3
InChIKeyUOEJOCQODMKDSA-UHFFFAOYSA-N
XLogP1.33
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine?
The IUPAC name of 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine (CID 130543295) is 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine.
What is the SMILES notation for 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine?
The canonical SMILES for 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine is COc1ncccc1C(C)(C)CN.
What is the InChIKey of 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine?
The InChIKey is UOEJOCQODMKDSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-10(2,7-11)8-5-4-6-12-9(8)13-3/h4-6H,7,11H2,1-3H3.
What are the key properties of 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine?
2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine has a molecular weight of 180.25 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine is sourced from PubChem (CID 130543295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).