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

C13H16N2O2 — CID 103853692

IUPACN-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine
SMILESC=CCCOCCNc1nccc2occc12
InChIInChI=1S/C13H16N2O2/c1-2-3-8-16-10-7-15-13-11-5-9-17-12(11)4-6-14-13/h2,4-6,9H,1,3,7-8,10H2,(H,14,15)
InChIKeyNVNRVRZFFCKHFJ-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.83
Rot. Bonds7

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

N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine (PubChem CID 103853692) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine
PubChem CID103853692
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC NameN-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine
SMILESC=CCCOCCNc1nccc2occc12
InChIInChI=1S/C13H16N2O2/c1-2-3-8-16-10-7-15-13-11-5-9-17-12(11)4-6-14-13/h2,4-6,9H,1,3,7-8,10H2,(H,14,15)
InChIKeyNVNRVRZFFCKHFJ-UHFFFAOYSA-N
XLogP2.83
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-aminoethoxy)ethyl]furo[3,2-c]pyridin-4-amine
CID 106535766
N-(2-but-3-enoxyethyl)isoquinolin-1-amine
CID 106405181
N-(2-methoxyethyl)furo[3,2-c]pyridin-4-amine
CID 90356822
2-[2-(furo[3,2-c]pyridin-4-ylamino)ethoxy]acetic acid
CID 106534922
5-bromo-N-(2-but-3-enoxyethyl)isoquinolin-1-amine
CID 103889043
N-(3-ethoxypropyl)furo[3,2-c]pyridin-4-amine
CID 103702457
N-[2-(4-aminophenoxy)ethyl]furo[3,2-c]pyridin-4-amine
CID 106535273
N-(2-but-3-enoxyethyl)-3-chloropyrazin-2-amine
CID 106405847
2-N-(2-but-3-enoxyethyl)pyridine-2,3-diamine
CID 106394208
N'-furo[3,2-c]pyridin-4-ylpropane-1,3-diamine
CID 106535052
N-(2-bromoprop-2-enyl)furo[3,2-c]pyridin-4-amine
CID 103702761
N'-furo[3,2-c]pyridin-4-ylbutane-1,4-diamine
CID 106535053

Frequently Asked Questions

What is the IUPAC name of N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine?
The IUPAC name of N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine (CID 103853692) is N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine is C=CCCOCCNc1nccc2occc12.
What is the InChIKey of N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine?
The InChIKey is NVNRVRZFFCKHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-2-3-8-16-10-7-15-13-11-5-9-17-12(11)4-6-14-13/h2,4-6,9H,1,3,7-8,10H2,(H,14,15).
What are the key properties of N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine?
N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine has a molecular weight of 232.28 g/mol, XLogP of 2.83, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-but-3-enoxyethyl)furo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 103853692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).