4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine

C12H16N4O — CID 105269050

IUPAC4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine
SMILESCc1occc1C(Cc1ccnc(N)c1)NN
InChIInChI=1S/C12H16N4O/c1-8-10(3-5-17-8)11(16-14)6-9-2-4-15-12(13)7-9/h2-5,7,11,16H,6,14H2,1H3,(H2,13,15)
InChIKeyZFFMVMZNIBVPKM-UHFFFAOYSA-N
MW232.29 g/mol
LogP1.31
Rot. Bonds4

About 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine

4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine (PubChem CID 105269050) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine
PubChem CID105269050
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine
SMILESCc1occc1C(Cc1ccnc(N)c1)NN
InChIInChI=1S/C12H16N4O/c1-8-10(3-5-17-8)11(16-14)6-9-2-4-15-12(13)7-9/h2-5,7,11,16H,6,14H2,1H3,(H2,13,15)
InChIKeyZFFMVMZNIBVPKM-UHFFFAOYSA-N
XLogP1.31
TPSA90.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine?
The IUPAC name of 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine (CID 105269050) is 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine is Cc1occc1C(Cc1ccnc(N)c1)NN.
What is the InChIKey of 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine?
The InChIKey is ZFFMVMZNIBVPKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-8-10(3-5-17-8)11(16-14)6-9-2-4-15-12(13)7-9/h2-5,7,11,16H,6,14H2,1H3,(H2,13,15).
What are the key properties of 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine?
4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine has a molecular weight of 232.29 g/mol, XLogP of 1.31, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-hydrazinyl-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 105269050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).