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

C12H16N2O2 — CID 103702457

IUPACN-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine
SMILESCCOCCCNc1nccc2occc12
InChIInChI=1S/C12H16N2O2/c1-2-15-8-3-6-13-12-10-5-9-16-11(10)4-7-14-12/h4-5,7,9H,2-3,6,8H2,1H3,(H,13,14)
InChIKeyXVPICLBRRMIMGG-UHFFFAOYSA-N
MW220.27 g/mol
LogP2.67
Rot. Bonds6

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

N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine (PubChem CID 103702457) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine
PubChem CID103702457
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine
SMILESCCOCCCNc1nccc2occc12
InChIInChI=1S/C12H16N2O2/c1-2-15-8-3-6-13-12-10-5-9-16-11(10)4-7-14-12/h4-5,7,9H,2-3,6,8H2,1H3,(H,13,14)
InChIKeyXVPICLBRRMIMGG-UHFFFAOYSA-N
XLogP2.67
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine?
The IUPAC name of N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine (CID 103702457) is N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine is CCOCCCNc1nccc2occc12.
What is the InChIKey of N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine?
The InChIKey is XVPICLBRRMIMGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-2-15-8-3-6-13-12-10-5-9-16-11(10)4-7-14-12/h4-5,7,9H,2-3,6,8H2,1H3,(H,13,14).
What are the key properties of N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine?
N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine has a molecular weight of 220.27 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 103702457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).