2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride

C7H12ClN3O — CID 175403125

IUPAC2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride
SMILESCl.Nc1cncc(NCCO)c1
InChIInChI=1S/C7H11N3O.ClH/c8-6-3-7(5-9-4-6)10-1-2-11;/h3-5,10-11H,1-2,8H2;1H
InChIKeyHGWVGURRPZAGFD-UHFFFAOYSA-N
MW189.65 g/mol
LogP0.49
Rot. Bonds3

About 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride

2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride (PubChem CID 175403125) has the molecular formula C7H12ClN3O and a molecular weight of 189.65 g/mol. Its IUPAC name is 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride.

Molecular Properties

Compound Name2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride
PubChem CID175403125
Molecular FormulaC7H12ClN3O
Molecular Weight189.65 g/mol
Exact Mass189.07
IUPAC Name2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride
SMILESCl.Nc1cncc(NCCO)c1
InChIInChI=1S/C7H11N3O.ClH/c8-6-3-7(5-9-4-6)10-1-2-11;/h3-5,10-11H,1-2,8H2;1H
InChIKeyHGWVGURRPZAGFD-UHFFFAOYSA-N
XLogP0.49
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.65
LogP ≤ 50.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-bromo-3-pyridinyl)amino]ethanol
CID 91636071
2-[[5-(methylamino)-3-pyridinyl]amino]ethanol
CID 104532515
5-N-(2-methylsulfanylethyl)pyridine-3,5-diamine
CID 104534747
4-[(5-amino-3-pyridinyl)amino]-3,3-dimethylbutan-1-ol
CID 106149745
5-N-ethylpyridine-3,5-diamine
CID 104532571
5-N-decylpyridine-3,5-diamine
CID 104535317
2-[(5-amino-3-pyridinyl)amino]ethanesulfonamide
CID 104532985
3-[(5-amino-3-pyridinyl)amino]-2,2-dimethylpropan-1-ol
CID 104535524
3-[(5-amino-3-pyridinyl)amino]propane-1-sulfonamide
CID 104533999
N-[3-[(5-amino-3-pyridinyl)amino]propyl]methanesulfonamide
CID 106332321
5-N-[2-(furan-2-yl)ethyl]pyridine-3,5-diamine
CID 104533462
5-N-[4-[methyl(propan-2-yl)amino]butyl]pyridine-3,5-diamine
CID 104534054

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride?
The IUPAC name of 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride (CID 175403125) is 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride.
What is the SMILES notation for 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride?
The canonical SMILES for 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride is Cl.Nc1cncc(NCCO)c1.
What is the InChIKey of 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride?
The InChIKey is HGWVGURRPZAGFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O.ClH/c8-6-3-7(5-9-4-6)10-1-2-11;/h3-5,10-11H,1-2,8H2;1H.
What are the key properties of 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride?
2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride has a molecular weight of 189.65 g/mol, XLogP of 0.49, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride is sourced from PubChem (CID 175403125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).