5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine

C11H13N3O — CID 43535641

IUPAC5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine
SMILESCC(Nc1ccc(N)nc1)c1ccco1
InChIInChI=1S/C11H13N3O/c1-8(10-3-2-6-15-10)14-9-4-5-11(12)13-7-9/h2-8,14H,1H3,(H2,12,13)
InChIKeyVNQHRJHFSCNYMB-UHFFFAOYSA-N
MW203.25 g/mol
LogP2.43
Rot. Bonds3

About 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine

5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine (PubChem CID 43535641) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine
PubChem CID43535641
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine
SMILESCC(Nc1ccc(N)nc1)c1ccco1
InChIInChI=1S/C11H13N3O/c1-8(10-3-2-6-15-10)14-9-4-5-11(12)13-7-9/h2-8,14H,1H3,(H2,12,13)
InChIKeyVNQHRJHFSCNYMB-UHFFFAOYSA-N
XLogP2.43
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine?
The IUPAC name of 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine (CID 43535641) is 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine.
What is the SMILES notation for 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine?
The canonical SMILES for 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine is CC(Nc1ccc(N)nc1)c1ccco1.
What is the InChIKey of 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine?
The InChIKey is VNQHRJHFSCNYMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-8(10-3-2-6-15-10)14-9-4-5-11(12)13-7-9/h2-8,14H,1H3,(H2,12,13).
What are the key properties of 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine?
5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine has a molecular weight of 203.25 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[1-(furan-2-yl)ethyl]pyridine-2,5-diamine is sourced from PubChem (CID 43535641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).