N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine

C11H15N3O2 — CID 106535766

IUPACN-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine
SMILESNCCOCCNc1nccc2occc12
InChIInChI=1S/C11H15N3O2/c12-3-7-15-8-5-14-11-9-2-6-16-10(9)1-4-13-11/h1-2,4,6H,3,5,7-8,12H2,(H,13,14)
InChIKeyQVMLROBDMYDZNE-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.22
Rot. Bonds6

About N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine

N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine (PubChem CID 106535766) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine
PubChem CID106535766
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine
SMILESNCCOCCNc1nccc2occc12
InChIInChI=1S/C11H15N3O2/c12-3-7-15-8-5-14-11-9-2-6-16-10(9)1-4-13-11/h1-2,4,6H,3,5,7-8,12H2,(H,13,14)
InChIKeyQVMLROBDMYDZNE-UHFFFAOYSA-N
XLogP1.22
TPSA73.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine?
The IUPAC name of N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine (CID 106535766) is N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine?
The canonical SMILES for N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine is NCCOCCNc1nccc2occc12.
What is the InChIKey of N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine?
The InChIKey is QVMLROBDMYDZNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c12-3-7-15-8-5-14-11-9-2-6-16-10(9)1-4-13-11/h1-2,4,6H,3,5,7-8,12H2,(H,13,14).
What are the key properties of N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine?
N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine has a molecular weight of 221.26 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 106535766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).