[6-(cyclopropylmethoxy)-2-pyridinyl]methanamine

C10H14N2O — CID 62291669

IUPAC[6-(cyclopropylmethoxy)-2-pyridinyl]methanamine
SMILESNCc1cccc(OCC2CC2)n1
InChIInChI=1S/C10H14N2O/c11-6-9-2-1-3-10(12-9)13-7-8-4-5-8/h1-3,8H,4-7,11H2
InChIKeyXNGNAMCJNAMZGQ-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.33
Rot. Bonds4

About [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine

[6-(cyclopropylmethoxy)-2-pyridinyl]methanamine (PubChem CID 62291669) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(cyclopropylmethoxy)-2-pyridinyl]methanamine
PubChem CID62291669
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name[6-(cyclopropylmethoxy)-2-pyridinyl]methanamine
SMILESNCc1cccc(OCC2CC2)n1
InChIInChI=1S/C10H14N2O/c11-6-9-2-1-3-10(12-9)13-7-8-4-5-8/h1-3,8H,4-7,11H2
InChIKeyXNGNAMCJNAMZGQ-UHFFFAOYSA-N
XLogP1.33
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine?
The IUPAC name of [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine (CID 62291669) is [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine?
The canonical SMILES for [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine is NCc1cccc(OCC2CC2)n1.
What is the InChIKey of [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine?
The InChIKey is XNGNAMCJNAMZGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c11-6-9-2-1-3-10(12-9)13-7-8-4-5-8/h1-3,8H,4-7,11H2.
What are the key properties of [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine?
[6-(cyclopropylmethoxy)-2-pyridinyl]methanamine has a molecular weight of 178.23 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(cyclopropylmethoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 62291669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).