N-butan-2-yl-5-hydrazinylpyridin-2-amine

C9H16N4 — CID 55282176

IUPACN-butan-2-yl-5-hydrazinylpyridin-2-amine
SMILESCCC(C)Nc1ccc(NN)cn1
InChIInChI=1S/C9H16N4/c1-3-7(2)12-9-5-4-8(13-10)6-11-9/h4-7,13H,3,10H2,1-2H3,(H,11,12)
InChIKeyMHZUUYZFZCMLSU-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.58
Rot. Bonds4

About N-butan-2-yl-5-hydrazinylpyridin-2-amine

N-butan-2-yl-5-hydrazinylpyridin-2-amine (PubChem CID 55282176) has the molecular formula C9H16N4 and a molecular weight of 180.25 g/mol. Its IUPAC name is N-butan-2-yl-5-hydrazinylpyridin-2-amine.

Molecular Properties

Compound NameN-butan-2-yl-5-hydrazinylpyridin-2-amine
PubChem CID55282176
Molecular FormulaC9H16N4
Molecular Weight180.25 g/mol
Exact Mass180.14
IUPAC NameN-butan-2-yl-5-hydrazinylpyridin-2-amine
SMILESCCC(C)Nc1ccc(NN)cn1
InChIInChI=1S/C9H16N4/c1-3-7(2)12-9-5-4-8(13-10)6-11-9/h4-7,13H,3,10H2,1-2H3,(H,11,12)
InChIKeyMHZUUYZFZCMLSU-UHFFFAOYSA-N
XLogP1.58
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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 N-butan-2-yl-5-hydrazinylpyridin-2-amine?
The IUPAC name of N-butan-2-yl-5-hydrazinylpyridin-2-amine (CID 55282176) is N-butan-2-yl-5-hydrazinylpyridin-2-amine.
What is the SMILES notation for N-butan-2-yl-5-hydrazinylpyridin-2-amine?
The canonical SMILES for N-butan-2-yl-5-hydrazinylpyridin-2-amine is CCC(C)Nc1ccc(NN)cn1.
What is the InChIKey of N-butan-2-yl-5-hydrazinylpyridin-2-amine?
The InChIKey is MHZUUYZFZCMLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-3-7(2)12-9-5-4-8(13-10)6-11-9/h4-7,13H,3,10H2,1-2H3,(H,11,12).
What are the key properties of N-butan-2-yl-5-hydrazinylpyridin-2-amine?
N-butan-2-yl-5-hydrazinylpyridin-2-amine has a molecular weight of 180.25 g/mol, XLogP of 1.58, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-5-hydrazinylpyridin-2-amine is sourced from PubChem (CID 55282176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).