6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride

C7H12ClN3O — CID 22731600

IUPAC6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride
SMILESCNc1nc(OC)ccc1N.Cl
InChIInChI=1S/C7H11N3O.ClH/c1-9-7-5(8)3-4-6(10-7)11-2;/h3-4H,8H2,1-2H3,(H,9,10);1H
InChIKeyYAWWVJJDKDCXFV-UHFFFAOYSA-N
MW189.65 g/mol
LogP1.14
Rot. Bonds2

About 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride

6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride (PubChem CID 22731600) has the molecular formula C7H12ClN3O and a molecular weight of 189.65 g/mol. Its IUPAC name is 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride.

Molecular Properties

Compound Name6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride
PubChem CID22731600
Molecular FormulaC7H12ClN3O
Molecular Weight189.65 g/mol
Exact Mass189.07
IUPAC Name6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride
SMILESCNc1nc(OC)ccc1N.Cl
InChIInChI=1S/C7H11N3O.ClH/c1-9-7-5(8)3-4-6(10-7)11-2;/h3-4H,8H2,1-2H3,(H,9,10);1H
InChIKeyYAWWVJJDKDCXFV-UHFFFAOYSA-N
XLogP1.14
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.65
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-(2,4-diaminophenoxy)propoxy]benzene-1,3-diamine;6-methoxy-2-N-methylpyridine-2,3-diamine
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6-methoxy-3-N-methylpyridine-2,3-diamine
CID 59159330
2-N-(2,5-dimethoxyphenyl)-6-methoxypyridine-2,3-diamine
CID 115320342
2-N-(3,5-dichlorophenyl)-6-methoxypyridine-2,3-diamine
CID 113286388
6-methoxy-2-N-(2-methylprop-2-enyl)pyridine-2,3-diamine
CID 114615186
6-methoxy-2-N-(4-methylpiperazin-1-yl)pyridine-2,3-diamine
CID 83005986
2-N-cyclohexyl-6-methoxypyridine-2,3-diamine
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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride?
The IUPAC name of 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride (CID 22731600) is 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride.
What is the SMILES notation for 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride?
The canonical SMILES for 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride is CNc1nc(OC)ccc1N.Cl.
What is the InChIKey of 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride?
The InChIKey is YAWWVJJDKDCXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O.ClH/c1-9-7-5(8)3-4-6(10-7)11-2;/h3-4H,8H2,1-2H3,(H,9,10);1H.
What are the key properties of 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride?
6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride has a molecular weight of 189.65 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride is sourced from PubChem (CID 22731600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).