4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol

C9H16N4O — CID 106847100

IUPAC4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol
SMILESNNc1cccc(NCCCCO)n1
InChIInChI=1S/C9H16N4O/c10-13-9-5-3-4-8(12-9)11-6-1-2-7-14/h3-5,14H,1-2,6-7,10H2,(H2,11,12,13)
InChIKeyIYUHGIUWKAPAIV-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.55
Rot. Bonds6

About 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol

4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol (PubChem CID 106847100) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol.

Molecular Properties

Compound Name4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol
PubChem CID106847100
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol
SMILESNNc1cccc(NCCCCO)n1
InChIInChI=1S/C9H16N4O/c10-13-9-5-3-4-8(12-9)11-6-1-2-7-14/h3-5,14H,1-2,6-7,10H2,(H2,11,12,13)
InChIKeyIYUHGIUWKAPAIV-UHFFFAOYSA-N
XLogP0.55
TPSA83.20 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.55
H-Bond Donors ≤ 54
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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Related Compounds

4-[(6-amino-2-pyridinyl)amino]butan-1-ol
CID 106846869
6-[(6-bromo-2-pyridinyl)amino]hexan-1-ol
CID 107854113
N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine
CID 80944940
6-[(6-methoxy-2-pyridinyl)amino]hexan-1-ol
CID 107848852
4-[(6-hydrazinyl-2-pyridinyl)amino]-3-methylbutan-1-ol
CID 80921705
6-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]hexan-1-ol
CID 107855025
6-hydrazinyl-N-(3-pyrrolidin-1-ylpropyl)pyridin-2-amine
CID 80914696
6-hydrazinyl-N-(3-methylbutyl)pyridin-2-amine
CID 80931651
5-[(6-ethoxy-2-pyridinyl)amino]pentan-1-ol
CID 107318017
2-N,6-N-dipentylpyridine-2,6-diamine
CID 66709787
3-[(6-hydrazinyl-2-pyridinyl)methylsulfanyl]propan-1-ol
CID 79232930
2-[(6-amino-2-pyridinyl)amino]ethanol
CID 66907238

Frequently Asked Questions

What is the IUPAC name of 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol?
The IUPAC name of 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol (CID 106847100) is 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol.
What is the SMILES notation for 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol?
The canonical SMILES for 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol is NNc1cccc(NCCCCO)n1.
What is the InChIKey of 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol?
The InChIKey is IYUHGIUWKAPAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c10-13-9-5-3-4-8(12-9)11-6-1-2-7-14/h3-5,14H,1-2,6-7,10H2,(H2,11,12,13).
What are the key properties of 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol?
4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol has a molecular weight of 196.25 g/mol, XLogP of 0.55, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol is sourced from PubChem (CID 106847100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).