3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine

C11H20N4O — CID 105210168

IUPAC3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine
SMILESCCCOCC(NN)c1cc(C)cnc1N
InChIInChI=1S/C11H20N4O/c1-3-4-16-7-10(15-13)9-5-8(2)6-14-11(9)12/h5-6,10,15H,3-4,7,13H2,1-2H3,(H2,12,14)
InChIKeyVMTQOJUDSFNIRQ-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.90
Rot. Bonds6

About 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine

3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine (PubChem CID 105210168) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine
PubChem CID105210168
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine
SMILESCCCOCC(NN)c1cc(C)cnc1N
InChIInChI=1S/C11H20N4O/c1-3-4-16-7-10(15-13)9-5-8(2)6-14-11(9)12/h5-6,10,15H,3-4,7,13H2,1-2H3,(H2,12,14)
InChIKeyVMTQOJUDSFNIRQ-UHFFFAOYSA-N
XLogP0.90
TPSA86.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine?
The IUPAC name of 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine (CID 105210168) is 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine.
What is the SMILES notation for 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine?
The canonical SMILES for 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine is CCCOCC(NN)c1cc(C)cnc1N.
What is the InChIKey of 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine?
The InChIKey is VMTQOJUDSFNIRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-3-4-16-7-10(15-13)9-5-8(2)6-14-11(9)12/h5-6,10,15H,3-4,7,13H2,1-2H3,(H2,12,14).
What are the key properties of 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine?
3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine has a molecular weight of 224.31 g/mol, XLogP of 0.90, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine is sourced from PubChem (CID 105210168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).