5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine

C9H15ClN4O — CID 105206436

IUPAC5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine
SMILESCOCCC(NN)c1cc(Cl)cnc1N
InChIInChI=1S/C9H15ClN4O/c1-15-3-2-8(14-12)7-4-6(10)5-13-9(7)11/h4-5,8,14H,2-3,12H2,1H3,(H2,11,13)
InChIKeyWSBXTPPHODDFHB-UHFFFAOYSA-N
MW230.70 g/mol
LogP0.86
Rot. Bonds5

About 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine

5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine (PubChem CID 105206436) has the molecular formula C9H15ClN4O and a molecular weight of 230.70 g/mol. Its IUPAC name is 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine
PubChem CID105206436
Molecular FormulaC9H15ClN4O
Molecular Weight230.70 g/mol
Exact Mass230.09
IUPAC Name5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine
SMILESCOCCC(NN)c1cc(Cl)cnc1N
InChIInChI=1S/C9H15ClN4O/c1-15-3-2-8(14-12)7-4-6(10)5-13-9(7)11/h4-5,8,14H,2-3,12H2,1H3,(H2,11,13)
InChIKeyWSBXTPPHODDFHB-UHFFFAOYSA-N
XLogP0.86
TPSA86.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.70
LogP ≤ 50.86
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 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine?
The IUPAC name of 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine (CID 105206436) is 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine is COCCC(NN)c1cc(Cl)cnc1N.
What is the InChIKey of 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine?
The InChIKey is WSBXTPPHODDFHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15ClN4O/c1-15-3-2-8(14-12)7-4-6(10)5-13-9(7)11/h4-5,8,14H,2-3,12H2,1H3,(H2,11,13).
What are the key properties of 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine?
5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine has a molecular weight of 230.70 g/mol, XLogP of 0.86, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine is sourced from PubChem (CID 105206436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).