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

C10H14N2O — CID 79787621

IUPAC[5-(cyclopropylmethoxy)-2-pyridinyl]methanamine
SMILESNCc1ccc(OCC2CC2)cn1
InChIInChI=1S/C10H14N2O/c11-5-9-3-4-10(6-12-9)13-7-8-1-2-8/h3-4,6,8H,1-2,5,7,11H2
InChIKeyIYICHBRKKUHKGO-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.33
Rot. Bonds4

About [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine

[5-(cyclopropylmethoxy)-2-pyridinyl]methanamine (PubChem CID 79787621) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[5-(cyclopropylmethoxy)-2-pyridinyl]methanamine
PubChem CID79787621
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name[5-(cyclopropylmethoxy)-2-pyridinyl]methanamine
SMILESNCc1ccc(OCC2CC2)cn1
InChIInChI=1S/C10H14N2O/c11-5-9-3-4-10(6-12-9)13-7-8-1-2-8/h3-4,6,8H,1-2,5,7,11H2
InChIKeyIYICHBRKKUHKGO-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 [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine?
The IUPAC name of [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine (CID 79787621) is [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine?
The canonical SMILES for [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine is NCc1ccc(OCC2CC2)cn1.
What is the InChIKey of [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine?
The InChIKey is IYICHBRKKUHKGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c11-5-9-3-4-10(6-12-9)13-7-8-1-2-8/h3-4,6,8H,1-2,5,7,11H2.
What are the key properties of [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine?
[5-(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 [5-(cyclopropylmethoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 79787621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).