2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride

C9H17Cl2N3O2 — CID 159916025

IUPAC2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride
SMILESCOc1nc(N(C)CCO)ccc1N.Cl.Cl
InChIInChI=1S/C9H15N3O2.2ClH/c1-12(5-6-13)8-4-3-7(10)9(11-8)14-2;;/h3-4,13H,5-6,10H2,1-2H3;2*1H
InChIKeyXRIGPZHOWFOCIH-UHFFFAOYSA-N
MW270.16 g/mol
LogP0.94
Rot. Bonds4

About 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride

2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride (PubChem CID 159916025) has the molecular formula C9H17Cl2N3O2 and a molecular weight of 270.16 g/mol. Its IUPAC name is 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride.

Molecular Properties

Compound Name2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride
PubChem CID159916025
Molecular FormulaC9H17Cl2N3O2
Molecular Weight270.16 g/mol
Exact Mass269.07
IUPAC Name2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride
SMILESCOc1nc(N(C)CCO)ccc1N.Cl.Cl
InChIInChI=1S/C9H15N3O2.2ClH/c1-12(5-6-13)8-4-3-7(10)9(11-8)14-2;;/h3-4,13H,5-6,10H2,1-2H3;2*1H
InChIKeyXRIGPZHOWFOCIH-UHFFFAOYSA-N
XLogP0.94
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.16
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-ethyl-6-methoxy-2-N-methylpyridine-2,5-diamine
CID 43263118
2-[(5-amino-6-methoxy-2-pyridinyl)-ethylamino]ethanol
CID 60958196
2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]acetic acid
CID 62253678
1-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]-3-methoxypropan-2-ol
CID 54993621
6-methoxy-2-N,2-N-dimethylpyridine-2,5-diamine
CID 43260741
2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
CID 43374936
2-[(5-amino-6-methoxy-2-pyridinyl)-(2,2-difluoroethyl)amino]ethanol
CID 107478117
6-methoxy-2-N-methyl-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine
CID 60892704
2-[(5-amino-6-methoxy-2-pyridinyl)-benzylamino]ethanol
CID 62114263
6-methoxy-2-N-methyl-2-N-pentan-3-ylpyridine-2,5-diamine
CID 43570932
6-methoxy-2-N-methyl-2-N-[(3-methylphenyl)methyl]pyridine-2,5-diamine
CID 61413982
6-methoxy-2-N,2-N-bis(2-methylpropyl)pyridine-2,5-diamine
CID 43587868

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride?
The IUPAC name of 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride (CID 159916025) is 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride.
What is the SMILES notation for 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride?
The canonical SMILES for 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride is COc1nc(N(C)CCO)ccc1N.Cl.Cl.
What is the InChIKey of 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride?
The InChIKey is XRIGPZHOWFOCIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2.2ClH/c1-12(5-6-13)8-4-3-7(10)9(11-8)14-2;;/h3-4,13H,5-6,10H2,1-2H3;2*1H.
What are the key properties of 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride?
2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride has a molecular weight of 270.16 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]ethanol;dihydrochloride is sourced from PubChem (CID 159916025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).